![N-[(2-cyanophenyl)carbamothioyl]-2-phenylacetamide structure](/static/products/6429/642969-77-5.webp)
N-[(2-cyanophenyl)carbamothioyl]-2-phenylacetamide
TL;DR: N-[(2-cyanophenyl)carbamothioyl]-2-phenylacetamide (CAS 642969-77-5) is a chemical compound with molecular formula C16H13N3OS and molecular weight 295.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-cyanophenyl)carbamothioyl]-2-phenylacetamide
Also Known As: N-[(2-cyanophenyl)carbamothioyl]-2-phenylacetamide, N-(2-cyanophenyl)-N'-(phenylacetyl)thiourea, AN-465/41166500
| Molecular Formula | C16H13N3OS |
|---|---|
| Molecular Weight | 295.08 g/mol |
| LogP | 2.61398 |
| Topological Polar Surface Area | 64.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 295.07794 |
| Heavy Atoms | 21 |
| Complexity | 692.16833 |
Chemical Identifiers
| CAS Number | 642969-77-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(=O)NC(=S)NC2=CC=CC=C2C#N |
Product Overview
N-[(2-cyanophenyl)carbamothioyl]-2-phenylacetamide (CAS 642969-77-5), with molecular formula C16H13N3OS and molecular weight 295.08 g/mol. IUPAC: N-[(2-cyanophenyl)carbamothioyl]-2-phenylacetamide.
Chemical Property Profile of N-[(2-cyanophenyl)carbamothioyl]-2-phenylacetamide
Property Insights of N-[(2-cyanophenyl)carbamothioyl]-2-phenylacetamide
The XLogP value of 2.61398 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(2-cyanophenyl)carbamothioyl]-2-phenylacetamide. The TPSA of 64.92 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(2-cyanophenyl)carbamothioyl]-2-phenylacetamide. Following Lipinski's Rule of Five, N-[(2-cyanophenyl)carbamothioyl]-2-phenylacetamide 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 N-[(2-cyanophenyl)carbamothioyl]-2-phenylacetamide?
The CAS number of N-[(2-cyanophenyl)carbamothioyl]-2-phenylacetamide is 642969-77-5.
What is the molecular formula of N-[(2-cyanophenyl)carbamothioyl]-2-phenylacetamide?
The molecular formula of N-[(2-cyanophenyl)carbamothioyl]-2-phenylacetamide is C16H13N3OS.
What is the molecular weight of N-[(2-cyanophenyl)carbamothioyl]-2-phenylacetamide?
The molecular weight of N-[(2-cyanophenyl)carbamothioyl]-2-phenylacetamide is 295.08 g/mol.
Where can I buy N-[(2-cyanophenyl)carbamothioyl]-2-phenylacetamide?
You can request a quote for N-[(2-cyanophenyl)carbamothioyl]-2-phenylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2-cyanophenyl)carbamothioyl]-2-phenylacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2-cyanophenyl)carbamothioyl]-2-phenylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.