![3-(4-butoxyphenyl)-N-[(4-chlorophenyl)methyl]-2-cyanoprop-2-enamide structure](/static/products/477/477974-04-2.png)
3-(4-butoxyphenyl)-N-[(4-chlorophenyl)methyl]-2-cyanoprop-2-enamide
TL;DR: 3-(4-butoxyphenyl)-N-[(4-chlorophenyl)methyl]-2-cyanoprop-2-enamide (CAS 477974-04-2) is a chemical compound with molecular formula C21H21ClN2O2 and molecular weight 368.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(4-butoxyphenyl)-N-[(4-chlorophenyl)methyl]-2-cyanoprop-2-enamide
Also Known As: AB00711836-01, (E)-3-(4-butoxyphenyl)-N-[(4-chlorophenyl)methyl]-2-cyanoprop-2-enamide, 3-(4-butoxyphenyl)-N-[(4-chlorophenyl)methyl]-2-cyanoprop-2-enamide
| Molecular Formula | C21H21ClN2O2 |
|---|---|
| Molecular Weight | 368.13 g/mol |
| LogP | 4.74228 |
| Topological Polar Surface Area | 62.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 368.12915 |
| Heavy Atoms | 26 |
| Complexity | 790.2559 |
Chemical Identifiers
| CAS Number | 477974-04-2 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NCC2=CC=C(C=C2)Cl |
Product Overview
3-(4-butoxyphenyl)-N-[(4-chlorophenyl)methyl]-2-cyanoprop-2-enamide (CAS 477974-04-2), with molecular formula C21H21ClN2O2 and molecular weight 368.13 g/mol. IUPAC: (E)-3-(4-butoxyphenyl)-N-[(4-chlorophenyl)methyl]-2-cyanoprop-2-enamide.
Chemical Property Profile of 3-(4-butoxyphenyl)-N-[(4-chlorophenyl)methyl]-2-cyanoprop-2-enamide
Property Insights of 3-(4-butoxyphenyl)-N-[(4-chlorophenyl)methyl]-2-cyanoprop-2-enamide
The XLogP value of 4.74228 indicates that 3-(4-butoxyphenyl)-N-[(4-chlorophenyl)methyl]-2-cyanoprop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.12 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-butoxyphenyl)-N-[(4-chlorophenyl)methyl]-2-cyanoprop-2-enamide. Following Lipinski's Rule of Five, 3-(4-butoxyphenyl)-N-[(4-chlorophenyl)methyl]-2-cyanoprop-2-enamide has 1 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-(4-butoxyphenyl)-N-[(4-chlorophenyl)methyl]-2-cyanoprop-2-enamide?
The CAS number of 3-(4-butoxyphenyl)-N-[(4-chlorophenyl)methyl]-2-cyanoprop-2-enamide is 477974-04-2.
What is the molecular formula of 3-(4-butoxyphenyl)-N-[(4-chlorophenyl)methyl]-2-cyanoprop-2-enamide?
The molecular formula of 3-(4-butoxyphenyl)-N-[(4-chlorophenyl)methyl]-2-cyanoprop-2-enamide is C21H21ClN2O2.
What is the molecular weight of 3-(4-butoxyphenyl)-N-[(4-chlorophenyl)methyl]-2-cyanoprop-2-enamide?
The molecular weight of 3-(4-butoxyphenyl)-N-[(4-chlorophenyl)methyl]-2-cyanoprop-2-enamide is 368.13 g/mol.
Where can I buy 3-(4-butoxyphenyl)-N-[(4-chlorophenyl)methyl]-2-cyanoprop-2-enamide?
You can request a quote for 3-(4-butoxyphenyl)-N-[(4-chlorophenyl)methyl]-2-cyanoprop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-butoxyphenyl)-N-[(4-chlorophenyl)methyl]-2-cyanoprop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-butoxyphenyl)-N-[(4-chlorophenyl)methyl]-2-cyanoprop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.