4-chloro-N-(pyridin-2-ylcarbamothioyl)benzamide
TL;DR: 4-chloro-N-(pyridin-2-ylcarbamothioyl)benzamide (CAS 105540-92-9) 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.
4-chloro-N-(pyridin-2-ylcarbamothioyl)benzamide
Also Known As: 4-chloro-N-(pyridin-2-ylcarbamothioyl)benzamide, 3-(4-chlorobenzoyl)-1-(pyridin-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 | 105540-92-9 |
|---|---|
| SMILES | C1=CC=NC(=C1)NC(=S)NC(=O)C2=CC=C(C=C2)Cl |
Product Overview
4-chloro-N-(pyridin-2-ylcarbamothioyl)benzamide (CAS 105540-92-9), with molecular formula C13H10ClN3OS and molecular weight 291.02 g/mol. IUPAC: 4-chloro-N-(pyridin-2-ylcarbamothioyl)benzamide.
Chemical Property Profile of 4-chloro-N-(pyridin-2-ylcarbamothioyl)benzamide
Property Insights of 4-chloro-N-(pyridin-2-ylcarbamothioyl)benzamide
The XLogP value of 2.8618 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-chloro-N-(pyridin-2-ylcarbamothioyl)benzamide. With a topological polar surface area (TPSA) of 54.02 Ų, 4-chloro-N-(pyridin-2-ylcarbamothioyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-chloro-N-(pyridin-2-ylcarbamothioyl)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 4-chloro-N-(pyridin-2-ylcarbamothioyl)benzamide?
The CAS number of 4-chloro-N-(pyridin-2-ylcarbamothioyl)benzamide is 105540-92-9.
What is the molecular formula of 4-chloro-N-(pyridin-2-ylcarbamothioyl)benzamide?
The molecular formula of 4-chloro-N-(pyridin-2-ylcarbamothioyl)benzamide is C13H10ClN3OS.
What is the molecular weight of 4-chloro-N-(pyridin-2-ylcarbamothioyl)benzamide?
The molecular weight of 4-chloro-N-(pyridin-2-ylcarbamothioyl)benzamide is 291.02 g/mol.
Where can I buy 4-chloro-N-(pyridin-2-ylcarbamothioyl)benzamide?
You can request a quote for 4-chloro-N-(pyridin-2-ylcarbamothioyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-N-(pyridin-2-ylcarbamothioyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-(pyridin-2-ylcarbamothioyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.