![4-{[(2-Chloroethyl)carbamoyl]amino}-n,n-dimethylbenzamide structure](/static/products/1391/13918-37-1.webp)
4-{[(2-Chloroethyl)carbamoyl]amino}-n,n-dimethylbenzamide
TL;DR: 4-{[(2-Chloroethyl)carbamoyl]amino}-n,n-dimethylbenzamide (CAS 13918-37-1) is a chemical compound with molecular formula C12H16ClN3O2 and molecular weight 269.0931 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(2-chloroethylcarbamoylamino)-N,N-dimethylbenzamide
Also Known As: 4-{[(2-chloroethyl)carbamoyl]amino}-n,n-dimethylbenzamide, 4-(2-chloroethylcarbamoylamino)-N,N-dimethylbenzamide, Urea, 1-(2-chloroethyl)-3-[p-(dimethylcarbamoyl)phenyl]-
Technical Specifications
| Molecular Formula | C12H16ClN3O2 |
| Molecular Weight | 269.0931 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 61.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 269.0931 Da |
| Heavy Atoms | 18 |
| Complexity | 289.0 |
| SMILES | CN(C)C(=O)C1=CC=C(C=C1)NC(=O)NCCCl |
| InChIKey | ZGLCEZMUTDVHOD-UHFFFAOYSA-N |
Chemical Property Profile of 4-{[(2-Chloroethyl)carbamoyl]amino}-n,n-dimethylbenzamide
Property Insights of 4-{[(2-Chloroethyl)carbamoyl]amino}-n,n-dimethylbenzamide
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{[(2-Chloroethyl)carbamoyl]amino}-n,n-dimethylbenzamide. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[(2-Chloroethyl)carbamoyl]amino}-n,n-dimethylbenzamide. Following Lipinski's Rule of Five, 4-{[(2-Chloroethyl)carbamoyl]amino}-n,n-dimethylbenzamide has 2 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-{[(2-Chloroethyl)carbamoyl]amino}-n,n-dimethylbenzamide?
The CAS number of 4-{[(2-Chloroethyl)carbamoyl]amino}-n,n-dimethylbenzamide is 13918-37-1.
What is the molecular formula of 4-{[(2-Chloroethyl)carbamoyl]amino}-n,n-dimethylbenzamide?
The molecular formula of 4-{[(2-Chloroethyl)carbamoyl]amino}-n,n-dimethylbenzamide is C12H16ClN3O2.
What is the molecular weight of 4-{[(2-Chloroethyl)carbamoyl]amino}-n,n-dimethylbenzamide?
The molecular weight of 4-{[(2-Chloroethyl)carbamoyl]amino}-n,n-dimethylbenzamide is 269.0931 g/mol.
Where can I buy 4-{[(2-Chloroethyl)carbamoyl]amino}-n,n-dimethylbenzamide?
You can request a quote for 4-{[(2-Chloroethyl)carbamoyl]amino}-n,n-dimethylbenzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-{[(2-Chloroethyl)carbamoyl]amino}-n,n-dimethylbenzamide?
Yes, CoreyChem provides custom synthesis services for 4-{[(2-Chloroethyl)carbamoyl]amino}-n,n-dimethylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.