(2E)-3-[(3,4-dimethoxyphenyl)amino]-1-pyridin-3-ylprop-2-en-1-one
TL;DR: (2E)-3-[(3,4-dimethoxyphenyl)amino]-1-pyridin-3-ylprop-2-en-1-one (CAS 428829-74-7) is a chemical compound with molecular formula C16H16N2O3 and molecular weight 284.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(3,4-dimethoxyanilino)-1-pyridin-3-ylprop-2-en-1-one
Also Known As: (2E)-3-[(3,4-dimethoxyphenyl)amino]-1-pyridin-3-ylprop-2-en-1-one, (E)-3-(3,4-dimethoxyanilino)-1-pyridin-3-ylprop-2-en-1-one
| Molecular Formula | C16H16N2O3 |
|---|---|
| Molecular Weight | 284.12 g/mol |
| LogP | 2.9073 |
| Topological Polar Surface Area | 60.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 284.1161 |
| Heavy Atoms | 21 |
| Complexity | 639.2253 |
Chemical Identifiers
| CAS Number | 428829-74-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)N/C=C/C(=O)C2=CN=CC=C2)OC |
Product Overview
(2E)-3-[(3,4-dimethoxyphenyl)amino]-1-pyridin-3-ylprop-2-en-1-one (CAS 428829-74-7), with molecular formula C16H16N2O3 and molecular weight 284.12 g/mol. IUPAC: (E)-3-(3,4-dimethoxyanilino)-1-pyridin-3-ylprop-2-en-1-one.
Chemical Property Profile of (2E)-3-[(3,4-dimethoxyphenyl)amino]-1-pyridin-3-ylprop-2-en-1-one
Property Insights of (2E)-3-[(3,4-dimethoxyphenyl)amino]-1-pyridin-3-ylprop-2-en-1-one
The XLogP value of 2.9073 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-3-[(3,4-dimethoxyphenyl)amino]-1-pyridin-3-ylprop-2-en-1-one. The TPSA of 60.45 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-3-[(3,4-dimethoxyphenyl)amino]-1-pyridin-3-ylprop-2-en-1-one. Following Lipinski's Rule of Five, (2E)-3-[(3,4-dimethoxyphenyl)amino]-1-pyridin-3-ylprop-2-en-1-one has 1 hydrogen bond donor(s) and 5 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 (2E)-3-[(3,4-dimethoxyphenyl)amino]-1-pyridin-3-ylprop-2-en-1-one?
The CAS number of (2E)-3-[(3,4-dimethoxyphenyl)amino]-1-pyridin-3-ylprop-2-en-1-one is 428829-74-7.
What is the molecular formula of (2E)-3-[(3,4-dimethoxyphenyl)amino]-1-pyridin-3-ylprop-2-en-1-one?
The molecular formula of (2E)-3-[(3,4-dimethoxyphenyl)amino]-1-pyridin-3-ylprop-2-en-1-one is C16H16N2O3.
What is the molecular weight of (2E)-3-[(3,4-dimethoxyphenyl)amino]-1-pyridin-3-ylprop-2-en-1-one?
The molecular weight of (2E)-3-[(3,4-dimethoxyphenyl)amino]-1-pyridin-3-ylprop-2-en-1-one is 284.12 g/mol.
Where can I buy (2E)-3-[(3,4-dimethoxyphenyl)amino]-1-pyridin-3-ylprop-2-en-1-one?
You can request a quote for (2E)-3-[(3,4-dimethoxyphenyl)amino]-1-pyridin-3-ylprop-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-3-[(3,4-dimethoxyphenyl)amino]-1-pyridin-3-ylprop-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for (2E)-3-[(3,4-dimethoxyphenyl)amino]-1-pyridin-3-ylprop-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.