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N-[2-(2,1,3-benzothiadiazol-4-yl)-1,3-dioxo-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-7-yl]-2-methoxy-4-methylsulfanylbenzamide structure
Fine Chemical

N-[2-(2,1,3-benzothiadiazol-4-yl)-1,3-dioxo-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-7-yl]-2-methoxy-4-methylsulfanylbenzamide

TL;DR: N-[2-(2,1,3-benzothiadiazol-4-yl)-1,3-dioxo-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-7-yl]-2-methoxy-4-methylsulfanylbenzamide (CAS 1040411-31-1) is a chemical compound with molecular formula C22H21N5O4S2 and molecular weight 483.1035 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-[2-(2,1,3-benzothiadiazol-4-yl)-1,3-dioxo-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-7-yl]-2-methoxy-4-methylsulfanylbenzamide

Also Known As: N-[2-(2,1,3-benzothiadiazol-4-yl)-1,3-dioxo-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-7-yl]-2-methoxy-4-methylsulfanylbenzamide

CAS Number
1040411-31-1
Molecular Formula
C22H21N5O4S2
Molecular Weight
483.1035 g/mol
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Technical Specifications

Molecular FormulaC22H21N5O4S2
Molecular Weight483.1035 g/mol
XLogP2.8
Topological Polar Surface Area (TPSA)158.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors8
Rotatable Bonds5
Exact Mass483.1035 Da
Heavy Atoms33
Complexity788.0
SMILESCOC1=C(C=CC(=C1)SC)C(=O)NC2CCN3C(C2)C(=O)N(C3=O)C4=CC=CC5=NSN=C54
InChIKeyCXYUNDHLKJCJEG-UHFFFAOYSA-N

Chemical Property Profile of N-[2-(2,1,3-benzothiadiazol-4-yl)-1,3-dioxo-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-7-yl]-2-methoxy-4-methylsulfanylbenzamide

XLogP
2.8
TPSA (Topological Polar Surface Area)
158.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
8
Rotatable Bonds
5
Heavy Atoms
33
Complexity
788.0
Exact Mass
483.1035
Monoisotopic Mass
483.1035
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 N-[2-(2,1,3-benzothiadiazol-4-yl)-1,3-dioxo-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-7-yl]-2-methoxy-4-methylsulfanylbenzamide

The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[2-(2,1,3-benzothiadiazol-4-yl)-1,3-dioxo-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-7-yl]-2-methoxy-4-methylsulfanylbenzamide. The TPSA of 158.0 Ų indicates high polarity, suggesting N-[2-(2,1,3-benzothiadiazol-4-yl)-1,3-dioxo-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-7-yl]-2-methoxy-4-methylsulfanylbenzamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-[2-(2,1,3-benzothiadiazol-4-yl)-1,3-dioxo-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-7-yl]-2-methoxy-4-methylsulfanylbenzamide has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of N-[2-(2,1,3-benzothiadiazol-4-yl)-1,3-dioxo-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-7-yl]-2-methoxy-4-methylsulfanylbenzamide?

The CAS number of N-[2-(2,1,3-benzothiadiazol-4-yl)-1,3-dioxo-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-7-yl]-2-methoxy-4-methylsulfanylbenzamide is 1040411-31-1.

What is the molecular formula of N-[2-(2,1,3-benzothiadiazol-4-yl)-1,3-dioxo-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-7-yl]-2-methoxy-4-methylsulfanylbenzamide?

The molecular formula of N-[2-(2,1,3-benzothiadiazol-4-yl)-1,3-dioxo-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-7-yl]-2-methoxy-4-methylsulfanylbenzamide is C22H21N5O4S2.

What is the molecular weight of N-[2-(2,1,3-benzothiadiazol-4-yl)-1,3-dioxo-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-7-yl]-2-methoxy-4-methylsulfanylbenzamide?

The molecular weight of N-[2-(2,1,3-benzothiadiazol-4-yl)-1,3-dioxo-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-7-yl]-2-methoxy-4-methylsulfanylbenzamide is 483.1035 g/mol.

Where can I buy N-[2-(2,1,3-benzothiadiazol-4-yl)-1,3-dioxo-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-7-yl]-2-methoxy-4-methylsulfanylbenzamide?

You can request a quote for N-[2-(2,1,3-benzothiadiazol-4-yl)-1,3-dioxo-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-7-yl]-2-methoxy-4-methylsulfanylbenzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for N-[2-(2,1,3-benzothiadiazol-4-yl)-1,3-dioxo-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-7-yl]-2-methoxy-4-methylsulfanylbenzamide?

Yes, CoreyChem provides custom synthesis services for N-[2-(2,1,3-benzothiadiazol-4-yl)-1,3-dioxo-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-7-yl]-2-methoxy-4-methylsulfanylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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