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(Z)-4-((3-(4-(6-methylbenzo[d]thiazol-2-yl)phenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)amino)-4-oxobutanoic acid structure
Fine Chemical

(Z)-4-((3-(4-(6-methylbenzo[d]thiazol-2-yl)phenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)amino)-4-oxobutanoic acid

TL;DR: (Z)-4-((3-(4-(6-methylbenzo[d]thiazol-2-yl)phenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)amino)-4-oxobutanoic acid (CAS 1164502-66-2) is a chemical compound with molecular formula C23H21N3O5S3 and molecular weight 515.06433 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-[[3-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]amino]-4-oxobutanoic acid

Also Known As: (Z)-4-((3-(4-(6-methylbenzo[d]thiazol-2-yl)phenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)amino)-4-oxobutanoic acid, 4-[[3-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]amino]-4-oxobutanoic acid, 4-{[(2Z)-3-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]amino}-4-oxobutanoic acid, N-[3-[4-(6-Methyl-benzothiazol-2-yl)-phenyl]-5,5-dioxo-hexahydro-5lambda*6*-thieno[3,4-d]thiazol-(2Z)-ylidene]-succinamic acid

CAS Number
1164502-66-2
Molecular Formula
C23H21N3O5S3
Molecular Weight
515.06433 g/mol
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Technical Specifications

Molecular FormulaC23H21N3O5S3
Molecular Weight515.06433 g/mol
XLogP3.3
Topological Polar Surface Area (TPSA)179.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors8
Rotatable Bonds5
Exact Mass515.06433 Da
Heavy Atoms34
Complexity944.0
SMILESCC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N4C5CS(=O)(=O)CC5SC4=NC(=O)CCC(=O)O
InChIKeyVJSXQLSQRFNGLH-UHFFFAOYSA-N

Chemical Property Profile of (Z)-4-((3-(4-(6-methylbenzo[d]thiazol-2-yl)phenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)amino)-4-oxobutanoic acid

XLogP
3.3
TPSA (Topological Polar Surface Area)
179.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
8
Rotatable Bonds
5
Heavy Atoms
34
Complexity
944.0
Exact Mass
515.06433
Monoisotopic Mass
515.06433
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of (Z)-4-((3-(4-(6-methylbenzo[d]thiazol-2-yl)phenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)amino)-4-oxobutanoic acid

The XLogP value of 3.3 indicates that (Z)-4-((3-(4-(6-methylbenzo[d]thiazol-2-yl)phenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)amino)-4-oxobutanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 179.0 Ų indicates high polarity, suggesting (Z)-4-((3-(4-(6-methylbenzo[d]thiazol-2-yl)phenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)amino)-4-oxobutanoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (Z)-4-((3-(4-(6-methylbenzo[d]thiazol-2-yl)phenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)amino)-4-oxobutanoic acid has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of (Z)-4-((3-(4-(6-methylbenzo[d]thiazol-2-yl)phenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)amino)-4-oxobutanoic acid?

The CAS number of (Z)-4-((3-(4-(6-methylbenzo[d]thiazol-2-yl)phenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)amino)-4-oxobutanoic acid is 1164502-66-2.

What is the molecular formula of (Z)-4-((3-(4-(6-methylbenzo[d]thiazol-2-yl)phenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)amino)-4-oxobutanoic acid?

The molecular formula of (Z)-4-((3-(4-(6-methylbenzo[d]thiazol-2-yl)phenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)amino)-4-oxobutanoic acid is C23H21N3O5S3.

What is the molecular weight of (Z)-4-((3-(4-(6-methylbenzo[d]thiazol-2-yl)phenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)amino)-4-oxobutanoic acid?

The molecular weight of (Z)-4-((3-(4-(6-methylbenzo[d]thiazol-2-yl)phenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)amino)-4-oxobutanoic acid is 515.06433 g/mol.

Where can I buy (Z)-4-((3-(4-(6-methylbenzo[d]thiazol-2-yl)phenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)amino)-4-oxobutanoic acid?

You can request a quote for (Z)-4-((3-(4-(6-methylbenzo[d]thiazol-2-yl)phenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)amino)-4-oxobutanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for (Z)-4-((3-(4-(6-methylbenzo[d]thiazol-2-yl)phenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)amino)-4-oxobutanoic acid?

Yes, CoreyChem provides custom synthesis services for (Z)-4-((3-(4-(6-methylbenzo[d]thiazol-2-yl)phenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3H)-ylidene)amino)-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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