![N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide structure](/static/products/3143/31430-26-9.webp)
N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide
TL;DR: N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide (CAS 31430-26-9) is a chemical compound with molecular formula C13H10ClN3OS and molecular weight 291.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5-chloro-2-pyridinyl)carbamothioyl]benzamide
Also Known As: N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide, BAS 02851851, 1-benzoyl-3-(5-chloropyridin-2-yl)thiourea, N-((5-Chloropyridin-2-yl)carbamothioyl)benzamide, N-benzoyl-N'-(5-chloropyridin-2-yl)thiourea
| Molecular Formula | C13H10ClN3OS |
|---|---|
| Molecular Weight | 291.02 g/mol |
| LogP | 2.8618 |
| Topological Polar Surface Area | 54.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 291.02332 |
| Heavy Atoms | 19 |
| Complexity | 586.59717 |
Chemical Identifiers
| CAS Number | 31430-26-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC(=S)NC2=NC=C(C=C2)Cl |
Product Overview
N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide (CAS 31430-26-9), with molecular formula C13H10ClN3OS and molecular weight 291.02 g/mol. IUPAC: N-[(5-chloro-2-pyridinyl)carbamothioyl]benzamide.
Chemical Property Profile of N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide
Property Insights of N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide
The XLogP value of 2.8618 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide. With a topological polar surface area (TPSA) of 54.02 Ų, N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide 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]benzamide?
The CAS number of N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide is 31430-26-9.
What is the molecular formula of N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide?
The molecular formula of N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide is C13H10ClN3OS.
What is the molecular weight of N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide?
The molecular weight of N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide is 291.02 g/mol.
Where can I buy N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide?
You can request a quote for N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide 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]benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(5-chloropyridin-2-yl)carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.