N-butyl-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyanoprop-2-enamide
TL;DR: N-butyl-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyanoprop-2-enamide (CAS 929977-48-0) is a chemical compound with molecular formula C15H17ClN2O3 and molecular weight 308.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-N-butyl-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyanoprop-2-enamide
Also Known As: (Z)-N-Butyl-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyanoprop-2-enamide, N-butyl-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyanoprop-2-enamide
| Molecular Formula | C15H17ClN2O3 |
|---|---|
| Molecular Weight | 308.09 g/mol |
| LogP | 2.87748 |
| Topological Polar Surface Area | 82.35 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 308.09277 |
| Heavy Atoms | 21 |
| Complexity | 591.3169 |
Chemical Identifiers
| CAS Number | 929977-48-0 |
|---|---|
| SMILES | CCCCNC(=O)/C(=C\C1=CC(=C(C(=C1)Cl)O)OC)/C#N |
Product Overview
N-butyl-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyanoprop-2-enamide (CAS 929977-48-0), with molecular formula C15H17ClN2O3 and molecular weight 308.09 g/mol. IUPAC: (Z)-N-butyl-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyanoprop-2-enamide.
Chemical Property Profile of N-butyl-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyanoprop-2-enamide
Property Insights of N-butyl-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyanoprop-2-enamide
The XLogP value of 2.87748 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-butyl-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyanoprop-2-enamide. The TPSA of 82.35 Ų falls within the moderate polarity range, balancing permeability and solubility for N-butyl-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyanoprop-2-enamide. Following Lipinski's Rule of Five, N-butyl-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyanoprop-2-enamide has 2 hydrogen bond donor(s) and 4 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 N-butyl-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyanoprop-2-enamide?
The CAS number of N-butyl-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyanoprop-2-enamide is 929977-48-0.
What is the molecular formula of N-butyl-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyanoprop-2-enamide?
The molecular formula of N-butyl-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyanoprop-2-enamide is C15H17ClN2O3.
What is the molecular weight of N-butyl-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyanoprop-2-enamide?
The molecular weight of N-butyl-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyanoprop-2-enamide is 308.09 g/mol.
Where can I buy N-butyl-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyanoprop-2-enamide?
You can request a quote for N-butyl-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-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 N-butyl-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyanoprop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for N-butyl-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyanoprop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.