Urea, 2-acetyl-1-phenyl-2-thio-
TL;DR: Urea, 2-acetyl-1-phenyl-2-thio- (CAS 61629-27-4) is a chemical compound with molecular formula C9H12N2OS and molecular weight 196.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-[amino(anilino)methyl] ethanethioate
Also Known As: S-Acetyl-1-phenyl thiourea, USAF EL-93, Urea, 2-acetyl-1-phenyl-2-thio-, S-[amino(anilino)methyl] ethanethioate, S-Amino(anilino)methyl ethanethioate
| Molecular Formula | C9H12N2OS |
|---|---|
| Molecular Weight | 196.07 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 80.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 196.06703 |
| Heavy Atoms | 13 |
| Complexity | 169.0 |
Chemical Identifiers
| CAS Number | 61629-27-4 |
|---|---|
| SMILES | CC(=O)SC(N)NC1=CC=CC=C1 |
| InChIKey | MNFFDYUSNKRWBD-UHFFFAOYSA-N |
Product Overview
Urea, 2-acetyl-1-phenyl-2-thio- (CAS 61629-27-4), with molecular formula C9H12N2OS and molecular weight 196.07 g/mol. IUPAC: S-[amino(anilino)methyl] ethanethioate.
Chemical Property Profile of Urea, 2-acetyl-1-phenyl-2-thio-
Property Insights of Urea, 2-acetyl-1-phenyl-2-thio-
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, 2-acetyl-1-phenyl-2-thio-. The TPSA of 80.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, 2-acetyl-1-phenyl-2-thio-. Following Lipinski's Rule of Five, Urea, 2-acetyl-1-phenyl-2-thio- has 2 hydrogen bond donor(s) and 4 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 Urea, 2-acetyl-1-phenyl-2-thio-?
The CAS number of Urea, 2-acetyl-1-phenyl-2-thio- is 61629-27-4.
What is the molecular formula of Urea, 2-acetyl-1-phenyl-2-thio-?
The molecular formula of Urea, 2-acetyl-1-phenyl-2-thio- is C9H12N2OS.
What is the molecular weight of Urea, 2-acetyl-1-phenyl-2-thio-?
The molecular weight of Urea, 2-acetyl-1-phenyl-2-thio- is 196.07 g/mol.
Where can I buy Urea, 2-acetyl-1-phenyl-2-thio-?
You can request a quote for Urea, 2-acetyl-1-phenyl-2-thio- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, 2-acetyl-1-phenyl-2-thio-?
Yes, KEHONG BIO provides custom synthesis services for Urea, 2-acetyl-1-phenyl-2-thio- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.