4-chloro-N-(diethylcarbamothioyl)benzamide
TL;DR: 4-chloro-N-(diethylcarbamothioyl)benzamide (CAS 101724-81-6) is a chemical compound with molecular formula C12H15ClN2OS and molecular weight 270.05936 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-chloro-N-(diethylcarbamothioyl)benzamide
Also Known As: 4-chloro-N-(diethylcarbamothioyl)benzamide, 1,1-Diethyl-3-(4-chlorobenzoyl)thiourea, N'-(4-chlorobenzoyl)-N,N-diethylthiourea, N-(Diethylthiocarbamoyl)-4-chlorobenzamide, N-(4-Chlorobenzoyl)-N',N'-diethylthiourea
Technical Specifications
| Molecular Formula | C12H15ClN2OS |
| Molecular Weight | 270.05936 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 64.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 270.05936 Da |
| Heavy Atoms | 17 |
| Complexity | 274.0 |
| SMILES | CCN(CC)C(=S)NC(=O)C1=CC=C(C=C1)Cl |
| InChIKey | HEWDLGIDGRUCHT-UHFFFAOYSA-N |
Chemical Property Profile of 4-chloro-N-(diethylcarbamothioyl)benzamide
Property Insights of 4-chloro-N-(diethylcarbamothioyl)benzamide
The XLogP value of 3.0 indicates that 4-chloro-N-(diethylcarbamothioyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-N-(diethylcarbamothioyl)benzamide. Following Lipinski's Rule of Five, 4-chloro-N-(diethylcarbamothioyl)benzamide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-chloro-N-(diethylcarbamothioyl)benzamide?
The CAS number of 4-chloro-N-(diethylcarbamothioyl)benzamide is 101724-81-6.
What is the molecular formula of 4-chloro-N-(diethylcarbamothioyl)benzamide?
The molecular formula of 4-chloro-N-(diethylcarbamothioyl)benzamide is C12H15ClN2OS.
What is the molecular weight of 4-chloro-N-(diethylcarbamothioyl)benzamide?
The molecular weight of 4-chloro-N-(diethylcarbamothioyl)benzamide is 270.05936 g/mol.
Where can I buy 4-chloro-N-(diethylcarbamothioyl)benzamide?
You can request a quote for 4-chloro-N-(diethylcarbamothioyl)benzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-chloro-N-(diethylcarbamothioyl)benzamide?
Yes, CoreyChem provides custom synthesis services for 4-chloro-N-(diethylcarbamothioyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.