Benzoic acid, 5-[[(ethylamino)thioxomethyl]amino]-2-hydroxy-
TL;DR: Benzoic acid, 5-[[(ethylamino)thioxomethyl]amino]-2-hydroxy- (CAS 62773-59-5) is a chemical compound with molecular formula C10H12N2O3S and molecular weight 240.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(ethylcarbamothioylamino)-2-hydroxybenzoic acid
Also Known As: 5-(ethylcarbamothioylamino)-2-hydroxybenzoic acid, 5-(3-ethylthioureido)-2-hydroxybenzoic acid, 5-(ethylthiocarbamoylamino)-2-hydroxy-benzoic Acid, Benzoic acid, 5-[[(ethylamino)thioxomethyl]amino]-2-hydroxy-, 5-{[(ethylamino)thioxomethyl]amino}-2-hydroxybenzoic acid
| Molecular Formula | C10H12N2O3S |
|---|---|
| Molecular Weight | 240.06 g/mol |
| LogP | 1.3967 |
| Topological Polar Surface Area | 81.59 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 240.05687 |
| Heavy Atoms | 16 |
| Complexity | 420.5252 |
Chemical Identifiers
| CAS Number | 62773-59-5 |
|---|---|
| SMILES | CCNC(=S)NC1=CC(=C(C=C1)O)C(=O)O |
Product Overview
Benzoic acid, 5-[[(ethylamino)thioxomethyl]amino]-2-hydroxy- (CAS 62773-59-5), with molecular formula C10H12N2O3S and molecular weight 240.06 g/mol. IUPAC: 5-(ethylcarbamothioylamino)-2-hydroxybenzoic acid.
Chemical Property Profile of Benzoic acid, 5-[[(ethylamino)thioxomethyl]amino]-2-hydroxy-
Property Insights of Benzoic acid, 5-[[(ethylamino)thioxomethyl]amino]-2-hydroxy-
The XLogP value of 1.3967 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 5-[[(ethylamino)thioxomethyl]amino]-2-hydroxy-. The TPSA of 81.59 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 5-[[(ethylamino)thioxomethyl]amino]-2-hydroxy-. Following Lipinski's Rule of Five, Benzoic acid, 5-[[(ethylamino)thioxomethyl]amino]-2-hydroxy- 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, 5-[[(ethylamino)thioxomethyl]amino]-2-hydroxy-?
The CAS number of Benzoic acid, 5-[[(ethylamino)thioxomethyl]amino]-2-hydroxy- is 62773-59-5.
What is the molecular formula of Benzoic acid, 5-[[(ethylamino)thioxomethyl]amino]-2-hydroxy-?
The molecular formula of Benzoic acid, 5-[[(ethylamino)thioxomethyl]amino]-2-hydroxy- is C10H12N2O3S.
What is the molecular weight of Benzoic acid, 5-[[(ethylamino)thioxomethyl]amino]-2-hydroxy-?
The molecular weight of Benzoic acid, 5-[[(ethylamino)thioxomethyl]amino]-2-hydroxy- is 240.06 g/mol.
Where can I buy Benzoic acid, 5-[[(ethylamino)thioxomethyl]amino]-2-hydroxy-?
You can request a quote for Benzoic acid, 5-[[(ethylamino)thioxomethyl]amino]-2-hydroxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 5-[[(ethylamino)thioxomethyl]amino]-2-hydroxy-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 5-[[(ethylamino)thioxomethyl]amino]-2-hydroxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.