3-(2-Chloropropanoyl)-1-ethylurea
TL;DR: 3-(2-Chloropropanoyl)-1-ethylurea (CAS 554426-65-2) 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-(ethylcarbamoyl)propanamide
Also Known As: 3-(2-chloropropanoyl)-1-ethylurea, 1-(2-Chloro-propionyl)-3-ethyl-urea, 2-chloro-N-(ethylcarbamoyl)propanamide, 966-378-2, RefChem:490942
| Molecular Formula | C6H11ClN2O2 |
|---|---|
| Molecular Weight | 178.05 g/mol |
| LogP | 0.4594 |
| 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 | 158.66127 |
Chemical Identifiers
| CAS Number | 554426-65-2 |
|---|---|
| SMILES | CCNC(=O)NC(=O)C(C)Cl |
Product Overview
3-(2-Chloropropanoyl)-1-ethylurea (CAS 554426-65-2), with molecular formula C6H11ClN2O2 and molecular weight 178.05 g/mol. IUPAC: 2-chloro-N-(ethylcarbamoyl)propanamide.
Chemical Property Profile of 3-(2-Chloropropanoyl)-1-ethylurea
Property Insights of 3-(2-Chloropropanoyl)-1-ethylurea
The XLogP value of 0.4594 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-Chloropropanoyl)-1-ethylurea. With a topological polar surface area (TPSA) of 58.2 Ų, 3-(2-Chloropropanoyl)-1-ethylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Chloropropanoyl)-1-ethylurea 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 3-(2-Chloropropanoyl)-1-ethylurea?
The CAS number of 3-(2-Chloropropanoyl)-1-ethylurea is 554426-65-2.
What is the molecular formula of 3-(2-Chloropropanoyl)-1-ethylurea?
The molecular formula of 3-(2-Chloropropanoyl)-1-ethylurea is C6H11ClN2O2.
What is the molecular weight of 3-(2-Chloropropanoyl)-1-ethylurea?
The molecular weight of 3-(2-Chloropropanoyl)-1-ethylurea is 178.05 g/mol.
Where can I buy 3-(2-Chloropropanoyl)-1-ethylurea?
You can request a quote for 3-(2-Chloropropanoyl)-1-ethylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Chloropropanoyl)-1-ethylurea?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Chloropropanoyl)-1-ethylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.