(E)-3-(3,4-difluorophenyl)-2-(3,4-dihydro-2H-quinoline-1-carbonyl)prop-2-enenitrile
TL;DR: (E)-3-(3,4-difluorophenyl)-2-(3,4-dihydro-2H-quinoline-1-carbonyl)prop-2-enenitrile (CAS 328038-69-3) is a chemical compound with molecular formula C19H14F2N2O and molecular weight 324.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(3,4-difluorophenyl)-2-(3,4-dihydro-2H-quinoline-1-carbonyl)prop-2-enenitrile
Also Known As: (E)-3-(3,4-difluorophenyl)-2-(3,4-dihydro-2H-quinoline-1-carbonyl)prop-2-enenitrile, 3-(3,4-difluorophenyl)-2-(1,2,3,4-tetrahydroquinoline-1-carbonyl)prop-2-enenitrile
| Molecular Formula | C19H14F2N2O |
|---|---|
| Molecular Weight | 324.11 g/mol |
| LogP | 3.85118 |
| Topological Polar Surface Area | 44.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 324.10742 |
| Heavy Atoms | 24 |
| Complexity | 867.91077 |
Chemical Identifiers
| CAS Number | 328038-69-3 |
|---|---|
| SMILES | C1CC2=CC=CC=C2N(C1)C(=O)/C(=C/C3=CC(=C(C=C3)F)F)/C#N |
Product Overview
(E)-3-(3,4-difluorophenyl)-2-(3,4-dihydro-2H-quinoline-1-carbonyl)prop-2-enenitrile (CAS 328038-69-3), with molecular formula C19H14F2N2O and molecular weight 324.11 g/mol. IUPAC: (E)-3-(3,4-difluorophenyl)-2-(3,4-dihydro-2H-quinoline-1-carbonyl)prop-2-enenitrile.
Chemical Property Profile of (E)-3-(3,4-difluorophenyl)-2-(3,4-dihydro-2H-quinoline-1-carbonyl)prop-2-enenitrile
Property Insights of (E)-3-(3,4-difluorophenyl)-2-(3,4-dihydro-2H-quinoline-1-carbonyl)prop-2-enenitrile
The XLogP value of 3.85118 indicates that (E)-3-(3,4-difluorophenyl)-2-(3,4-dihydro-2H-quinoline-1-carbonyl)prop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.1 Ų, (E)-3-(3,4-difluorophenyl)-2-(3,4-dihydro-2H-quinoline-1-carbonyl)prop-2-enenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-3-(3,4-difluorophenyl)-2-(3,4-dihydro-2H-quinoline-1-carbonyl)prop-2-enenitrile has 0 hydrogen bond donor(s) and 2 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 (E)-3-(3,4-difluorophenyl)-2-(3,4-dihydro-2H-quinoline-1-carbonyl)prop-2-enenitrile?
The CAS number of (E)-3-(3,4-difluorophenyl)-2-(3,4-dihydro-2H-quinoline-1-carbonyl)prop-2-enenitrile is 328038-69-3.
What is the molecular formula of (E)-3-(3,4-difluorophenyl)-2-(3,4-dihydro-2H-quinoline-1-carbonyl)prop-2-enenitrile?
The molecular formula of (E)-3-(3,4-difluorophenyl)-2-(3,4-dihydro-2H-quinoline-1-carbonyl)prop-2-enenitrile is C19H14F2N2O.
What is the molecular weight of (E)-3-(3,4-difluorophenyl)-2-(3,4-dihydro-2H-quinoline-1-carbonyl)prop-2-enenitrile?
The molecular weight of (E)-3-(3,4-difluorophenyl)-2-(3,4-dihydro-2H-quinoline-1-carbonyl)prop-2-enenitrile is 324.11 g/mol.
Where can I buy (E)-3-(3,4-difluorophenyl)-2-(3,4-dihydro-2H-quinoline-1-carbonyl)prop-2-enenitrile?
You can request a quote for (E)-3-(3,4-difluorophenyl)-2-(3,4-dihydro-2H-quinoline-1-carbonyl)prop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-(3,4-difluorophenyl)-2-(3,4-dihydro-2H-quinoline-1-carbonyl)prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(3,4-difluorophenyl)-2-(3,4-dihydro-2H-quinoline-1-carbonyl)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.