1-(2-Chloro-acetyl)-3-isopropyl-urea
TL;DR: 1-(2-Chloro-acetyl)-3-isopropyl-urea (CAS 93359-23-0) is a chemical compound with molecular formula C6H11ClN2O2 and molecular weight 178.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(propan-2-ylcarbamoyl)acetamide
Also Known As: 1-(2-chloro-acetyl)-3-isopropyl-urea, 3-(2-chloroacetyl)-1-(propan-2-yl)urea, 2-chloro-N-(propan-2-ylcarbamoyl)acetamide, 2-Chloro-N-(isopropylcarbamoyl)acetamide, 1- -3-ISOPROPYL-UREA
| Molecular Formula | C6H11ClN2O2 |
|---|---|
| Molecular Weight | 178.05 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 178.0509 |
| Heavy Atoms | 11 |
| Complexity | 159.0 |
Chemical Identifiers
| CAS Number | 93359-23-0 |
|---|---|
| SMILES | CC(C)NC(=O)NC(=O)CCl |
| InChIKey | VNNSRORYYYMSJR-UHFFFAOYSA-N |
Product Overview
1-(2-Chloro-acetyl)-3-isopropyl-urea (CAS 93359-23-0), with molecular formula C6H11ClN2O2 and molecular weight 178.05 g/mol. IUPAC: 2-chloro-N-(propan-2-ylcarbamoyl)acetamide.
Chemical Property Profile of 1-(2-Chloro-acetyl)-3-isopropyl-urea
Property Insights of 1-(2-Chloro-acetyl)-3-isopropyl-urea
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Chloro-acetyl)-3-isopropyl-urea. With a topological polar surface area (TPSA) of 58.2 Ų, 1-(2-Chloro-acetyl)-3-isopropyl-urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Chloro-acetyl)-3-isopropyl-urea 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
Frequently Asked Questions
What is the CAS number of 1-(2-Chloro-acetyl)-3-isopropyl-urea?
The CAS number of 1-(2-Chloro-acetyl)-3-isopropyl-urea is 93359-23-0.
What is the molecular formula of 1-(2-Chloro-acetyl)-3-isopropyl-urea?
The molecular formula of 1-(2-Chloro-acetyl)-3-isopropyl-urea is C6H11ClN2O2.
What is the molecular weight of 1-(2-Chloro-acetyl)-3-isopropyl-urea?
The molecular weight of 1-(2-Chloro-acetyl)-3-isopropyl-urea is 178.05 g/mol.
Where can I buy 1-(2-Chloro-acetyl)-3-isopropyl-urea?
You can request a quote for 1-(2-Chloro-acetyl)-3-isopropyl-urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Chloro-acetyl)-3-isopropyl-urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Chloro-acetyl)-3-isopropyl-urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.