![2-chloro-N-[(methylcarbamoylamino)-sulfanylidenemethyl]benzamide structure](/static/products/1387/138712-72-8.webp)
2-chloro-N-[(methylcarbamoylamino)-sulfanylidenemethyl]benzamide
TL;DR: 2-chloro-N-[(methylcarbamoylamino)-sulfanylidenemethyl]benzamide (CAS 138712-72-8) is a chemical compound with molecular formula C10H10ClN3O2S and molecular weight 271.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(methylcarbamoylcarbamothioyl)benzamide
Also Known As: 2-chloro-N-{[(methylcarbamoyl)amino]methanethioyl}benzamide, 2-chloro-N-(methylcarbamoylcarbamothioyl)benzamide, 1-chloro-2-{[({[(methylamino)carbonyl]amino}carbothioyl)amino]carbonyl}benzene, 1-(2-Chlorobenzoyl)-5-methylthiobiuret, 2-chloro-N-[(methylcarbamoylamino)-sulfanylidenemethyl]benzamide
| Molecular Formula | C10H10ClN3O2S |
|---|---|
| Molecular Weight | 271.02 g/mol |
| LogP | 1.2837 |
| Topological Polar Surface Area | 70.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 271.01822 |
| Heavy Atoms | 17 |
| Complexity | 464.61917 |
Chemical Identifiers
| CAS Number | 138712-72-8 |
|---|---|
| SMILES | CNC(=O)NC(=S)NC(=O)C1=CC=CC=C1Cl |
Product Overview
2-chloro-N-[(methylcarbamoylamino)-sulfanylidenemethyl]benzamide (CAS 138712-72-8), with molecular formula C10H10ClN3O2S and molecular weight 271.02 g/mol. IUPAC: 2-chloro-N-(methylcarbamoylcarbamothioyl)benzamide.
Chemical Property Profile of 2-chloro-N-[(methylcarbamoylamino)-sulfanylidenemethyl]benzamide
Property Insights of 2-chloro-N-[(methylcarbamoylamino)-sulfanylidenemethyl]benzamide
The XLogP value of 1.2837 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-N-[(methylcarbamoylamino)-sulfanylidenemethyl]benzamide. The TPSA of 70.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-N-[(methylcarbamoylamino)-sulfanylidenemethyl]benzamide. Following Lipinski's Rule of Five, 2-chloro-N-[(methylcarbamoylamino)-sulfanylidenemethyl]benzamide has 3 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 2-chloro-N-[(methylcarbamoylamino)-sulfanylidenemethyl]benzamide?
The CAS number of 2-chloro-N-[(methylcarbamoylamino)-sulfanylidenemethyl]benzamide is 138712-72-8.
What is the molecular formula of 2-chloro-N-[(methylcarbamoylamino)-sulfanylidenemethyl]benzamide?
The molecular formula of 2-chloro-N-[(methylcarbamoylamino)-sulfanylidenemethyl]benzamide is C10H10ClN3O2S.
What is the molecular weight of 2-chloro-N-[(methylcarbamoylamino)-sulfanylidenemethyl]benzamide?
The molecular weight of 2-chloro-N-[(methylcarbamoylamino)-sulfanylidenemethyl]benzamide is 271.02 g/mol.
Where can I buy 2-chloro-N-[(methylcarbamoylamino)-sulfanylidenemethyl]benzamide?
You can request a quote for 2-chloro-N-[(methylcarbamoylamino)-sulfanylidenemethyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-[(methylcarbamoylamino)-sulfanylidenemethyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-[(methylcarbamoylamino)-sulfanylidenemethyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.