3-(2,6-dichlorophenyl)-N-isopentylacrylamide
TL;DR: 3-(2,6-dichlorophenyl)-N-isopentylacrylamide (CAS 545371-50-4) is a chemical compound with molecular formula C14H17Cl2NO and molecular weight 285.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(2,6-dichlorophenyl)-N-(3-methylbutyl)prop-2-enamide
Also Known As: 3-(2,6-dichlorophenyl)-N-isopentylacrylamide, (E)-3-(2,6-dichlorophenyl)-N-(3-methylbutyl)prop-2-enamide, (2E)-3-(2,6-dichlorophenyl)-N-(3-methylbutyl)prop-2-enamide
| Molecular Formula | C14H17Cl2NO |
|---|---|
| Molecular Weight | 285.07 g/mol |
| LogP | 4.1689 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 285.06873 |
| Heavy Atoms | 18 |
| Complexity | 421.17017 |
Chemical Identifiers
| CAS Number | 545371-50-4 |
|---|---|
| SMILES | CC(C)CCNC(=O)/C=C/C1=C(C=CC=C1Cl)Cl |
Product Overview
3-(2,6-dichlorophenyl)-N-isopentylacrylamide (CAS 545371-50-4), with molecular formula C14H17Cl2NO and molecular weight 285.07 g/mol. IUPAC: (E)-3-(2,6-dichlorophenyl)-N-(3-methylbutyl)prop-2-enamide.
Chemical Property Profile of 3-(2,6-dichlorophenyl)-N-isopentylacrylamide
Property Insights of 3-(2,6-dichlorophenyl)-N-isopentylacrylamide
The XLogP value of 4.1689 indicates that 3-(2,6-dichlorophenyl)-N-isopentylacrylamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 3-(2,6-dichlorophenyl)-N-isopentylacrylamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2,6-dichlorophenyl)-N-isopentylacrylamide has 1 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 3-(2,6-dichlorophenyl)-N-isopentylacrylamide?
The CAS number of 3-(2,6-dichlorophenyl)-N-isopentylacrylamide is 545371-50-4.
What is the molecular formula of 3-(2,6-dichlorophenyl)-N-isopentylacrylamide?
The molecular formula of 3-(2,6-dichlorophenyl)-N-isopentylacrylamide is C14H17Cl2NO.
What is the molecular weight of 3-(2,6-dichlorophenyl)-N-isopentylacrylamide?
The molecular weight of 3-(2,6-dichlorophenyl)-N-isopentylacrylamide is 285.07 g/mol.
Where can I buy 3-(2,6-dichlorophenyl)-N-isopentylacrylamide?
You can request a quote for 3-(2,6-dichlorophenyl)-N-isopentylacrylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,6-dichlorophenyl)-N-isopentylacrylamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,6-dichlorophenyl)-N-isopentylacrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.