![N-[(2-chloropyridin-3-yl)carbamothioyl]-2-methylbenzamide structure](/static/products/866/866014-43-9.png)
N-[(2-chloropyridin-3-yl)carbamothioyl]-2-methylbenzamide
TL;DR: N-[(2-chloropyridin-3-yl)carbamothioyl]-2-methylbenzamide (CAS 866014-43-9) 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-[(2-chloro-3-pyridinyl)carbamothioyl]-2-methylbenzamide
Also Known As: N-[(2-chloropyridin-3-yl)carbamothioyl]-2-methylbenzamide, 1-(2-CHLOROPYRIDIN-3-YL)-3-(2-METHYLBENZOYL)THIOUREA, F1601-0466, N-((2-chloropyridin-3-yl)carbamothioyl)-2-methylbenzamide
| Molecular Formula | C14H12ClN3OS |
|---|---|
| Molecular Weight | 305.04 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 86.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 305.03897 |
| Heavy Atoms | 20 |
| Complexity | 366.0 |
Chemical Identifiers
| CAS Number | 866014-43-9 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)NC(=S)NC2=C(N=CC=C2)Cl |
| InChIKey | GWBFCLCNPMJOFI-UHFFFAOYSA-N |
Product Overview
N-[(2-chloropyridin-3-yl)carbamothioyl]-2-methylbenzamide (CAS 866014-43-9), with molecular formula C14H12ClN3OS and molecular weight 305.04 g/mol. IUPAC: N-[(2-chloro-3-pyridinyl)carbamothioyl]-2-methylbenzamide.
Chemical Property Profile of N-[(2-chloropyridin-3-yl)carbamothioyl]-2-methylbenzamide
Property Insights of N-[(2-chloropyridin-3-yl)carbamothioyl]-2-methylbenzamide
The XLogP value of 3.8 indicates that N-[(2-chloropyridin-3-yl)carbamothioyl]-2-methylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.1 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(2-chloropyridin-3-yl)carbamothioyl]-2-methylbenzamide. Following Lipinski's Rule of Five, N-[(2-chloropyridin-3-yl)carbamothioyl]-2-methylbenzamide 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-chloropyridin-3-yl)carbamothioyl]-2-methylbenzamide?
The CAS number of N-[(2-chloropyridin-3-yl)carbamothioyl]-2-methylbenzamide is 866014-43-9.
What is the molecular formula of N-[(2-chloropyridin-3-yl)carbamothioyl]-2-methylbenzamide?
The molecular formula of N-[(2-chloropyridin-3-yl)carbamothioyl]-2-methylbenzamide is C14H12ClN3OS.
What is the molecular weight of N-[(2-chloropyridin-3-yl)carbamothioyl]-2-methylbenzamide?
The molecular weight of N-[(2-chloropyridin-3-yl)carbamothioyl]-2-methylbenzamide is 305.04 g/mol.
Where can I buy N-[(2-chloropyridin-3-yl)carbamothioyl]-2-methylbenzamide?
You can request a quote for N-[(2-chloropyridin-3-yl)carbamothioyl]-2-methylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2-chloropyridin-3-yl)carbamothioyl]-2-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2-chloropyridin-3-yl)carbamothioyl]-2-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.