3-(2-Chloroacetyl)-1-[(thiophen-2-yl)methyl]urea
TL;DR: 3-(2-Chloroacetyl)-1-[(thiophen-2-yl)methyl]urea (CAS 871909-81-8) is a chemical compound with molecular formula C8H9ClN2O2S and molecular weight 232.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(thiophen-2-ylmethylcarbamoyl)acetamide
Also Known As: 3-(2-Chloroacetyl)-1-[(thiophen-2-yl)methyl]urea, 2-chloro-N-{[(thien-2-ylmethyl)amino]carbonyl}acetamide, UPCMLD0ENAT5449380:001, 2-Chloro-N-((thiophen-2-ylmethyl)carbamoyl)acetamide, 3-(2-chloroacetyl)-1-(thiophen-2-ylmethyl)urea
| Molecular Formula | C8H9ClN2O2S |
|---|---|
| Molecular Weight | 232.01 g/mol |
| LogP | 1.3127 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 232.00732 |
| Heavy Atoms | 14 |
| Complexity | 313.151 |
Chemical Identifiers
| CAS Number | 871909-81-8 |
|---|---|
| SMILES | C1=CSC(=C1)CNC(=O)NC(=O)CCl |
Product Overview
3-(2-Chloroacetyl)-1-[(thiophen-2-yl)methyl]urea (CAS 871909-81-8), with molecular formula C8H9ClN2O2S and molecular weight 232.01 g/mol. IUPAC: 2-chloro-N-(thiophen-2-ylmethylcarbamoyl)acetamide.
Chemical Property Profile of 3-(2-Chloroacetyl)-1-[(thiophen-2-yl)methyl]urea
Property Insights of 3-(2-Chloroacetyl)-1-[(thiophen-2-yl)methyl]urea
The XLogP value of 1.3127 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-Chloroacetyl)-1-[(thiophen-2-yl)methyl]urea. With a topological polar surface area (TPSA) of 58.2 Ų, 3-(2-Chloroacetyl)-1-[(thiophen-2-yl)methyl]urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Chloroacetyl)-1-[(thiophen-2-yl)methyl]urea has 2 hydrogen bond donor(s) and 3 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-Chloroacetyl)-1-[(thiophen-2-yl)methyl]urea?
The CAS number of 3-(2-Chloroacetyl)-1-[(thiophen-2-yl)methyl]urea is 871909-81-8.
What is the molecular formula of 3-(2-Chloroacetyl)-1-[(thiophen-2-yl)methyl]urea?
The molecular formula of 3-(2-Chloroacetyl)-1-[(thiophen-2-yl)methyl]urea is C8H9ClN2O2S.
What is the molecular weight of 3-(2-Chloroacetyl)-1-[(thiophen-2-yl)methyl]urea?
The molecular weight of 3-(2-Chloroacetyl)-1-[(thiophen-2-yl)methyl]urea is 232.01 g/mol.
Where can I buy 3-(2-Chloroacetyl)-1-[(thiophen-2-yl)methyl]urea?
You can request a quote for 3-(2-Chloroacetyl)-1-[(thiophen-2-yl)methyl]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Chloroacetyl)-1-[(thiophen-2-yl)methyl]urea?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Chloroacetyl)-1-[(thiophen-2-yl)methyl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.