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N-[(5-chloropyridin-2-yl)carbamothioyl]-2-phenylacetamide
TL;DR: N-[(5-chloropyridin-2-yl)carbamothioyl]-2-phenylacetamide (CAS 78852-09-2) is a chemical compound with molecular formula C14H12ClN3OS and molecular weight 305.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5-chloro-2-pyridinyl)carbamothioyl]-2-phenylacetamide
Also Known As: N-(5-chloro-2-pyridinyl)-N'-(phenylacetyl)thiourea, N-[(5-chloropyridin-2-yl)carbamothioyl]-2-phenylacetamide, AM-879/40769414, N-(5-Chloro-2-pyridinyl)-N/'-(phenylacetyl)thiourea
| Molecular Formula | C14H12ClN3OS |
|---|---|
| Molecular Weight | 305.04 g/mol |
| LogP | 2.7907 |
| Topological Polar Surface Area | 54.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 305.03897 |
| Heavy Atoms | 20 |
| Complexity | 601.5759 |
Chemical Identifiers
| CAS Number | 78852-09-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(=O)NC(=S)NC2=NC=C(C=C2)Cl |
Product Overview
N-[(5-chloropyridin-2-yl)carbamothioyl]-2-phenylacetamide (CAS 78852-09-2), with molecular formula C14H12ClN3OS and molecular weight 305.04 g/mol. IUPAC: N-[(5-chloro-2-pyridinyl)carbamothioyl]-2-phenylacetamide.
Chemical Property Profile of N-[(5-chloropyridin-2-yl)carbamothioyl]-2-phenylacetamide
Property Insights of N-[(5-chloropyridin-2-yl)carbamothioyl]-2-phenylacetamide
The XLogP value of 2.7907 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(5-chloropyridin-2-yl)carbamothioyl]-2-phenylacetamide. With a topological polar surface area (TPSA) of 54.02 Ų, N-[(5-chloropyridin-2-yl)carbamothioyl]-2-phenylacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(5-chloropyridin-2-yl)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-[(5-chloropyridin-2-yl)carbamothioyl]-2-phenylacetamide?
The CAS number of N-[(5-chloropyridin-2-yl)carbamothioyl]-2-phenylacetamide is 78852-09-2.
What is the molecular formula of N-[(5-chloropyridin-2-yl)carbamothioyl]-2-phenylacetamide?
The molecular formula of N-[(5-chloropyridin-2-yl)carbamothioyl]-2-phenylacetamide is C14H12ClN3OS.
What is the molecular weight of N-[(5-chloropyridin-2-yl)carbamothioyl]-2-phenylacetamide?
The molecular weight of N-[(5-chloropyridin-2-yl)carbamothioyl]-2-phenylacetamide is 305.04 g/mol.
Where can I buy N-[(5-chloropyridin-2-yl)carbamothioyl]-2-phenylacetamide?
You can request a quote for N-[(5-chloropyridin-2-yl)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-[(5-chloropyridin-2-yl)carbamothioyl]-2-phenylacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(5-chloropyridin-2-yl)carbamothioyl]-2-phenylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.