![4-[[[[Oxo-(4-phenylphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid structure](/static/products/4343/434306-07-7.webp)
4-[[[[Oxo-(4-phenylphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid
TL;DR: 4-[[[[Oxo-(4-phenylphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid (CAS 434306-07-7) is a chemical compound with molecular formula C21H16N2O3S and molecular weight 376.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-phenylbenzoyl)carbamothioylamino]benzoic acid
Also Known As: 4-[(4-phenylbenzoyl)carbamothioylamino]benzoic acid, AN-465/41523077, 4-[(4-phenylbenzoyl)thiocarbamoylamino]benzoic acid, 4-[[[[oxo-(4-phenylphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid, 4-[3-(Biphenyl-4-carbonyl)-thioureido]-benzoic acid
| Molecular Formula | C21H16N2O3S |
|---|---|
| Molecular Weight | 376.09 g/mol |
| LogP | 4.1786 |
| Topological Polar Surface Area | 78.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 376.08817 |
| Heavy Atoms | 27 |
| Complexity | 968.57324 |
Chemical Identifiers
| CAS Number | 434306-07-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NC(=S)NC3=CC=C(C=C3)C(=O)O |
Product Overview
4-[[[[Oxo-(4-phenylphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid (CAS 434306-07-7), with molecular formula C21H16N2O3S and molecular weight 376.09 g/mol. IUPAC: 4-[(4-phenylbenzoyl)carbamothioylamino]benzoic acid.
Chemical Property Profile of 4-[[[[Oxo-(4-phenylphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid
Property Insights of 4-[[[[Oxo-(4-phenylphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid
The XLogP value of 4.1786 indicates that 4-[[[[Oxo-(4-phenylphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[[[[Oxo-(4-phenylphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid. Following Lipinski's Rule of Five, 4-[[[[Oxo-(4-phenylphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-[[[[Oxo-(4-phenylphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid?
The CAS number of 4-[[[[Oxo-(4-phenylphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid is 434306-07-7.
What is the molecular formula of 4-[[[[Oxo-(4-phenylphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid?
The molecular formula of 4-[[[[Oxo-(4-phenylphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid is C21H16N2O3S.
What is the molecular weight of 4-[[[[Oxo-(4-phenylphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid?
The molecular weight of 4-[[[[Oxo-(4-phenylphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid is 376.09 g/mol.
Where can I buy 4-[[[[Oxo-(4-phenylphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid?
You can request a quote for 4-[[[[Oxo-(4-phenylphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[[[[Oxo-(4-phenylphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[[[[Oxo-(4-phenylphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.