1-(2-Chloroethyl)-3-(1-methylcyclopentyl)urea
TL;DR: 1-(2-Chloroethyl)-3-(1-methylcyclopentyl)urea (CAS 13908-09-3) is a chemical compound with molecular formula C9H17ClN2O and molecular weight 204.10294 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-chloroethyl)-3-(1-methylcyclopentyl)urea
Also Known As: 1-(2-chloroethyl)-3-(1-methylcyclopentyl)urea, KST-1B0377, Bicyclo[3.1.0]hex-3-en-2-one,4-methoxy, N-(2-Chloroethyl)-N'-(1-methylcyclopentyl)urea
Technical Specifications
| Molecular Formula | C9H17ClN2O |
| Molecular Weight | 204.10294 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 204.10294 Da |
| Heavy Atoms | 13 |
| Complexity | 178.0 |
| SMILES | CC1(CCCC1)NC(=O)NCCCl |
| InChIKey | QUMYOFKTVGNGMH-UHFFFAOYSA-N |
Chemical Property Profile of 1-(2-Chloroethyl)-3-(1-methylcyclopentyl)urea
Property Insights of 1-(2-Chloroethyl)-3-(1-methylcyclopentyl)urea
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Chloroethyl)-3-(1-methylcyclopentyl)urea. With a topological polar surface area (TPSA) of 41.1 Ų, 1-(2-Chloroethyl)-3-(1-methylcyclopentyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Chloroethyl)-3-(1-methylcyclopentyl)urea has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(2-Chloroethyl)-3-(1-methylcyclopentyl)urea?
The CAS number of 1-(2-Chloroethyl)-3-(1-methylcyclopentyl)urea is 13908-09-3.
What is the molecular formula of 1-(2-Chloroethyl)-3-(1-methylcyclopentyl)urea?
The molecular formula of 1-(2-Chloroethyl)-3-(1-methylcyclopentyl)urea is C9H17ClN2O.
What is the molecular weight of 1-(2-Chloroethyl)-3-(1-methylcyclopentyl)urea?
The molecular weight of 1-(2-Chloroethyl)-3-(1-methylcyclopentyl)urea is 204.10294 g/mol.
Where can I buy 1-(2-Chloroethyl)-3-(1-methylcyclopentyl)urea?
You can request a quote for 1-(2-Chloroethyl)-3-(1-methylcyclopentyl)urea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(2-Chloroethyl)-3-(1-methylcyclopentyl)urea?
Yes, CoreyChem provides custom synthesis services for 1-(2-Chloroethyl)-3-(1-methylcyclopentyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.