![Carbamothioic acid, S-[2-oxo-2-(phenylamino)ethyl] ester structure](/static/products/6287/6287-71-4.webp)
Carbamothioic acid, S-[2-oxo-2-(phenylamino)ethyl] ester
TL;DR: Carbamothioic acid, S-[2-oxo-2-(phenylamino)ethyl] ester (CAS 6287-71-4) is a chemical compound with molecular formula C9H10N2O2S and molecular weight 210.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-(2-anilino-2-oxoethyl) carbamothioate
Also Known As: USAF uctl-1766, Carbaminothioglycolic acid anilide, Carbaminylglykolsaeureanilid, 2-(Carbamoylthio)acetanilide, s-(2-anilino-2-oxoethyl) carbamothioate
| Molecular Formula | C9H10N2O2S |
|---|---|
| Molecular Weight | 210.05 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 97.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 210.0463 |
| Heavy Atoms | 14 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 6287-71-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)CSC(=O)N |
| InChIKey | CEINNGQDMFZTJK-UHFFFAOYSA-N |
Product Overview
Carbamothioic acid, S-[2-oxo-2-(phenylamino)ethyl] ester (CAS 6287-71-4), with molecular formula C9H10N2O2S and molecular weight 210.05 g/mol. IUPAC: S-(2-anilino-2-oxoethyl) carbamothioate.
Chemical Property Profile of Carbamothioic acid, S-[2-oxo-2-(phenylamino)ethyl] ester
Property Insights of Carbamothioic acid, S-[2-oxo-2-(phenylamino)ethyl] ester
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamothioic acid, S-[2-oxo-2-(phenylamino)ethyl] ester. The TPSA of 97.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamothioic acid, S-[2-oxo-2-(phenylamino)ethyl] ester. Following Lipinski's Rule of Five, Carbamothioic acid, S-[2-oxo-2-(phenylamino)ethyl] ester has 2 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 Carbamothioic acid, S-[2-oxo-2-(phenylamino)ethyl] ester?
The CAS number of Carbamothioic acid, S-[2-oxo-2-(phenylamino)ethyl] ester is 6287-71-4.
What is the molecular formula of Carbamothioic acid, S-[2-oxo-2-(phenylamino)ethyl] ester?
The molecular formula of Carbamothioic acid, S-[2-oxo-2-(phenylamino)ethyl] ester is C9H10N2O2S.
What is the molecular weight of Carbamothioic acid, S-[2-oxo-2-(phenylamino)ethyl] ester?
The molecular weight of Carbamothioic acid, S-[2-oxo-2-(phenylamino)ethyl] ester is 210.05 g/mol.
Where can I buy Carbamothioic acid, S-[2-oxo-2-(phenylamino)ethyl] ester?
You can request a quote for Carbamothioic acid, S-[2-oxo-2-(phenylamino)ethyl] ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamothioic acid, S-[2-oxo-2-(phenylamino)ethyl] ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamothioic acid, S-[2-oxo-2-(phenylamino)ethyl] ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.