![4-chloro-N-{[4-(dimethylamino)phenyl]carbamothioyl}benzamide structure](/static/products/4262/426235-34-9.webp)
4-chloro-N-{[4-(dimethylamino)phenyl]carbamothioyl}benzamide
TL;DR: 4-chloro-N-{[4-(dimethylamino)phenyl]carbamothioyl}benzamide (CAS 426235-34-9) is a chemical compound with molecular formula C16H16ClN3OS and molecular weight 333.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[[4-(dimethylamino)phenyl]carbamothioyl]benzamide
Also Known As: BAS 02854443, 4-chloro-N-{[4-(dimethylamino)phenyl]carbamothioyl}benzamide, AB00105599-01, N-(4-chlorobenzoyl)-N'-[4-(dimethylamino)phenyl]thiourea, 4-chloro-N-[[4-(dimethylamino)phenyl]carbamothioyl]benzamide
| Molecular Formula | C16H16ClN3OS |
|---|---|
| Molecular Weight | 333.07 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 76.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 333.07025 |
| Heavy Atoms | 22 |
| Complexity | 389.0 |
Chemical Identifiers
| CAS Number | 426235-34-9 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)Cl |
| InChIKey | GVTYKWLITISVLG-UHFFFAOYSA-N |
Product Overview
4-chloro-N-{[4-(dimethylamino)phenyl]carbamothioyl}benzamide (CAS 426235-34-9), with molecular formula C16H16ClN3OS and molecular weight 333.07 g/mol. IUPAC: 4-chloro-N-[[4-(dimethylamino)phenyl]carbamothioyl]benzamide.
Chemical Property Profile of 4-chloro-N-{[4-(dimethylamino)phenyl]carbamothioyl}benzamide
Property Insights of 4-chloro-N-{[4-(dimethylamino)phenyl]carbamothioyl}benzamide
The XLogP value of 4.3 indicates that 4-chloro-N-{[4-(dimethylamino)phenyl]carbamothioyl}benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-N-{[4-(dimethylamino)phenyl]carbamothioyl}benzamide. Following Lipinski's Rule of Five, 4-chloro-N-{[4-(dimethylamino)phenyl]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 4-chloro-N-{[4-(dimethylamino)phenyl]carbamothioyl}benzamide?
The CAS number of 4-chloro-N-{[4-(dimethylamino)phenyl]carbamothioyl}benzamide is 426235-34-9.
What is the molecular formula of 4-chloro-N-{[4-(dimethylamino)phenyl]carbamothioyl}benzamide?
The molecular formula of 4-chloro-N-{[4-(dimethylamino)phenyl]carbamothioyl}benzamide is C16H16ClN3OS.
What is the molecular weight of 4-chloro-N-{[4-(dimethylamino)phenyl]carbamothioyl}benzamide?
The molecular weight of 4-chloro-N-{[4-(dimethylamino)phenyl]carbamothioyl}benzamide is 333.07 g/mol.
Where can I buy 4-chloro-N-{[4-(dimethylamino)phenyl]carbamothioyl}benzamide?
You can request a quote for 4-chloro-N-{[4-(dimethylamino)phenyl]carbamothioyl}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-{[4-(dimethylamino)phenyl]carbamothioyl}benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-{[4-(dimethylamino)phenyl]carbamothioyl}benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.