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C27H26N4O6S structure
Fine Chemical

C27H26N4O6S

TL;DR: C27H26N4O6S (CAS 99616-23-6) is a chemical compound with molecular formula C27H26N4O6S and molecular weight 534.1573 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3,4,5-trimethoxy-N-[4-[[2-(4-methylphenyl)imino-4-oxo-1,3-thiazolidin-3-yl]carbamoyl]phenyl]benzamide

Also Known As: 3,4,5-trimethoxy-N-[4-[[2-(4-methylphenyl)imino-4-oxo-1,3-thiazolidin-3-yl]carbamoyl]phenyl]benzamide, Benzamide, N-(4-(((2-((4-methylphenyl)imino)-4-oxo-3-thiazolidinyl)amino)carbonyl)phenyl)-3,4,5-trimethoxy-, BENZAMIDE, N-(4-(((2-((4-METHYLPHENYL)IMINO)-4-OXO-3-THIAZOLIDINYL)AMINO)CARBONY

CAS Number
99616-23-6
Molecular Formula
C27H26N4O6S
Molecular Weight
534.1573 g/mol
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Technical Specifications

Molecular FormulaC27H26N4O6S
Molecular Weight534.1573 g/mol
XLogP4.4
Topological Polar Surface Area (TPSA)144.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors8
Rotatable Bonds7
Exact Mass534.1573 Da
Heavy Atoms38
Complexity858.0
SMILESCC1=CC=C(C=C1)N=C2N(C(=O)CS2)NC(=O)C3=CC=C(C=C3)NC(=O)C4=CC(=C(C(=C4)OC)OC)OC
InChIKeyWFLMECINXRRRJV-UHFFFAOYSA-N

Chemical Property Profile of C27H26N4O6S

XLogP
4.4
TPSA (Topological Polar Surface Area)
144.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
8
Rotatable Bonds
7
Heavy Atoms
38
Complexity
858.0
Exact Mass
534.1573
Monoisotopic Mass
534.1573
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 C27H26N4O6S

The XLogP value of 4.4 indicates that C27H26N4O6S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 144.0 Ų indicates high polarity, suggesting C27H26N4O6S may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C27H26N4O6S has 2 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 C27H26N4O6S?

The CAS number of C27H26N4O6S is 99616-23-6.

What is the molecular formula of C27H26N4O6S?

The molecular formula of C27H26N4O6S is C27H26N4O6S.

What is the molecular weight of C27H26N4O6S?

The molecular weight of C27H26N4O6S is 534.1573 g/mol.

Where can I buy C27H26N4O6S?

You can request a quote for C27H26N4O6S directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for C27H26N4O6S?

Yes, CoreyChem provides custom synthesis services for C27H26N4O6S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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