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Benzoic acid, 2-hydroxy-5-[[(phenylamino)thioxomethyl]amino]-
TL;DR: Benzoic acid, 2-hydroxy-5-[[(phenylamino)thioxomethyl]amino]- (CAS 62773-62-0) is a chemical compound with molecular formula C14H12N2O3S and molecular weight 288.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-5-(phenylcarbamothioylamino)benzoic acid
Also Known As: 2-hydroxy-5-(phenylcarbamothioylamino)benzoic acid, 2-hydroxy-5-(phenylthiocarbamoylamino)benzoic Acid, Benzoic acid, 2-hydroxy-5-[[(phenylamino)thioxomethyl]amino]-, 2-hydroxy-5-{[(phenylamino)thioxomethyl]amino}benzoic acid, 2-HYDROXY-5-[(PHENYLCARBAMOTHIOYL)AMINO]BENZOIC ACID
| Molecular Formula | C14H12N2O3S |
|---|---|
| Molecular Weight | 288.06 g/mol |
| LogP | 2.8993 |
| Topological Polar Surface Area | 81.59 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 288.05685 |
| Heavy Atoms | 20 |
| Complexity | 644.1222 |
Chemical Identifiers
| CAS Number | 62773-62-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=S)NC2=CC(=C(C=C2)O)C(=O)O |
Product Overview
Benzoic acid, 2-hydroxy-5-[[(phenylamino)thioxomethyl]amino]- (CAS 62773-62-0), with molecular formula C14H12N2O3S and molecular weight 288.06 g/mol. IUPAC: 2-hydroxy-5-(phenylcarbamothioylamino)benzoic acid.
Chemical Property Profile of Benzoic acid, 2-hydroxy-5-[[(phenylamino)thioxomethyl]amino]-
Property Insights of Benzoic acid, 2-hydroxy-5-[[(phenylamino)thioxomethyl]amino]-
The XLogP value of 2.8993 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 2-hydroxy-5-[[(phenylamino)thioxomethyl]amino]-. The TPSA of 81.59 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 2-hydroxy-5-[[(phenylamino)thioxomethyl]amino]-. Following Lipinski's Rule of Five, Benzoic acid, 2-hydroxy-5-[[(phenylamino)thioxomethyl]amino]- has 4 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 Benzoic acid, 2-hydroxy-5-[[(phenylamino)thioxomethyl]amino]-?
The CAS number of Benzoic acid, 2-hydroxy-5-[[(phenylamino)thioxomethyl]amino]- is 62773-62-0.
What is the molecular formula of Benzoic acid, 2-hydroxy-5-[[(phenylamino)thioxomethyl]amino]-?
The molecular formula of Benzoic acid, 2-hydroxy-5-[[(phenylamino)thioxomethyl]amino]- is C14H12N2O3S.
What is the molecular weight of Benzoic acid, 2-hydroxy-5-[[(phenylamino)thioxomethyl]amino]-?
The molecular weight of Benzoic acid, 2-hydroxy-5-[[(phenylamino)thioxomethyl]amino]- is 288.06 g/mol.
Where can I buy Benzoic acid, 2-hydroxy-5-[[(phenylamino)thioxomethyl]amino]-?
You can request a quote for Benzoic acid, 2-hydroxy-5-[[(phenylamino)thioxomethyl]amino]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-hydroxy-5-[[(phenylamino)thioxomethyl]amino]-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-hydroxy-5-[[(phenylamino)thioxomethyl]amino]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.