丁烯醯苯胺
TL;DR: 丁烯醯苯胺 (CAS 483-63-6) is a chemical compound with molecular formula C13H17NO and molecular weight 203.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
丁烯醯苯胺
N-ethyl-N-(2-methylphenyl)but-2-enamide
Also Known As: crotamiton, Eurax, Crotamitone, Crotalgin, Crotan
| Molecular Formula | C13H17NO |
|---|---|
| Molecular Weight | 203.13 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 203.13101 |
| Heavy Atoms | 15 |
| Complexity | 235.0 |
| Melting Point | < 25 °C |
| Boiling Point | 154 |
| Solubility | 3.53e-01 g/L |
Chemical Identifiers
| CAS Number | 483-63-6 |
|---|---|
| SMILES | CCN(C1=CC=CC=C1C)C(=O)C=CC |
| InChIKey | DNTGGZPQPQTDQF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
丁烯醯苯胺 (CAS 483-63-6), with molecular formula C13H17NO and molecular weight 203.13 g/mol. IUPAC: N-ethyl-N-(2-methylphenyl)but-2-enamide.
Chemical Property Profile of 丁烯醯苯胺
Property Insights of 丁烯醯苯胺
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 丁烯醯苯胺. With a topological polar surface area (TPSA) of 20.3 Ų, 丁烯醯苯胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 丁烯醯苯胺 has 0 hydrogen bond donor(s) and 1 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 丁烯醯苯胺?
The CAS number of 丁烯醯苯胺 is 483-63-6.
What is the molecular formula of 丁烯醯苯胺?
The molecular formula of 丁烯醯苯胺 is C13H17NO.
What is the molecular weight of 丁烯醯苯胺?
The molecular weight of 丁烯醯苯胺 is 203.13 g/mol.
Where can I buy 丁烯醯苯胺?
You can request a quote for 丁烯醯苯胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 丁烯醯苯胺?
Yes, KEHONG BIO provides custom synthesis services for 丁烯醯苯胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.