![2-chloro-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide structure](/static/products/4304/430446-15-4.webp)
2-chloro-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide
TL;DR: 2-chloro-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide (CAS 430446-15-4) is a chemical compound with molecular formula C18H18ClN3OS and molecular weight 359.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide
Also Known As: AB00112544-01, 2-chloro-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide, 2-chloro-N-{[4-(pyrrolidin-1-yl)phenyl]carbamothioyl}benzamide
| Molecular Formula | C18H18ClN3OS |
|---|---|
| Molecular Weight | 359.09 g/mol |
| LogP | 4.067 |
| Topological Polar Surface Area | 44.37 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 359.0859 |
| Heavy Atoms | 24 |
| Complexity | 742.184 |
Chemical Identifiers
| CAS Number | 430446-15-4 |
|---|---|
| SMILES | C1CCN(C1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3Cl |
Product Overview
2-chloro-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide (CAS 430446-15-4), with molecular formula C18H18ClN3OS and molecular weight 359.09 g/mol. IUPAC: 2-chloro-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide.
Chemical Property Profile of 2-chloro-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide
Property Insights of 2-chloro-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide
The XLogP value of 4.067 indicates that 2-chloro-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.37 Ų, 2-chloro-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-N-[(4-pyrrolidin-1-ylphenyl)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 2-chloro-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide?
The CAS number of 2-chloro-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide is 430446-15-4.
What is the molecular formula of 2-chloro-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide?
The molecular formula of 2-chloro-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide is C18H18ClN3OS.
What is the molecular weight of 2-chloro-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide?
The molecular weight of 2-chloro-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide is 359.09 g/mol.
Where can I buy 2-chloro-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide?
You can request a quote for 2-chloro-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]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-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.