1-(3-Carboxyphenyl)-2-thiourea
TL;DR: 1-(3-Carboxyphenyl)-2-thiourea (CAS 37463-85-7) is a chemical compound with molecular formula C8H8N2O2S and molecular weight 196.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(carbamothioylamino)benzoic acid
Also Known As: 1-(3-Carboxyphenyl)-2-thiourea, 3-thioureidobenzoic acid, 3-(carbamothioylamino)benzoic acid, 3-Carboxyphenylthiourea, 3-(carbamothioylamino)benzoicacid
| Molecular Formula | C8H8N2O2S |
|---|---|
| Molecular Weight | 196.03 g/mol |
| LogP | 1.0403 |
| Topological Polar Surface Area | 75.35 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 196.03065 |
| Heavy Atoms | 13 |
| Complexity | 351.7522 |
Chemical Identifiers
| CAS Number | 37463-85-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC(=S)N)C(=O)O |
Product Overview
1-(3-Carboxyphenyl)-2-thiourea (CAS 37463-85-7), with molecular formula C8H8N2O2S and molecular weight 196.03 g/mol. IUPAC: 3-(carbamothioylamino)benzoic acid.
Chemical Property Profile of 1-(3-Carboxyphenyl)-2-thiourea
Property Insights of 1-(3-Carboxyphenyl)-2-thiourea
The XLogP value of 1.0403 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Carboxyphenyl)-2-thiourea. The TPSA of 75.35 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-Carboxyphenyl)-2-thiourea. Following Lipinski's Rule of Five, 1-(3-Carboxyphenyl)-2-thiourea has 3 hydrogen bond donor(s) and 2 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 1-(3-Carboxyphenyl)-2-thiourea?
The CAS number of 1-(3-Carboxyphenyl)-2-thiourea is 37463-85-7.
What is the molecular formula of 1-(3-Carboxyphenyl)-2-thiourea?
The molecular formula of 1-(3-Carboxyphenyl)-2-thiourea is C8H8N2O2S.
What is the molecular weight of 1-(3-Carboxyphenyl)-2-thiourea?
The molecular weight of 1-(3-Carboxyphenyl)-2-thiourea is 196.03 g/mol.
Where can I buy 1-(3-Carboxyphenyl)-2-thiourea?
You can request a quote for 1-(3-Carboxyphenyl)-2-thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Carboxyphenyl)-2-thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Carboxyphenyl)-2-thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.