![2-[4-(3-Fluoropropoxy)phenyl]-3-(4-methylanilino)prop-2-enenitrile structure](/static/products/1164/1164536-11-1.webp)
2-[4-(3-Fluoropropoxy)phenyl]-3-(4-methylanilino)prop-2-enenitrile
TL;DR: 2-[4-(3-Fluoropropoxy)phenyl]-3-(4-methylanilino)prop-2-enenitrile (CAS 1164536-11-1) is a chemical compound with molecular formula C19H19FN2O and molecular weight 310.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(3-fluoropropoxy)phenyl]-3-(4-methylanilino)prop-2-enenitrile
Also Known As: (Z)-2-[4-(3-fluoropropoxy)phenyl]-3-(4-toluidino)-2-propenenitrile, 2-[4-(3-fluoropropoxy)phenyl]-3-(4-methylanilino)prop-2-enenitrile
| Molecular Formula | C19H19FN2O |
|---|---|
| Molecular Weight | 310.15 g/mol |
| LogP | 4.71 |
| Topological Polar Surface Area | 45.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 310.14813 |
| Heavy Atoms | 23 |
| Complexity | 684.8047 |
Chemical Identifiers
| CAS Number | 1164536-11-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC=C(C#N)C2=CC=C(C=C2)OCCCF |
Product Overview
2-[4-(3-Fluoropropoxy)phenyl]-3-(4-methylanilino)prop-2-enenitrile (CAS 1164536-11-1), with molecular formula C19H19FN2O and molecular weight 310.15 g/mol. IUPAC: 2-[4-(3-fluoropropoxy)phenyl]-3-(4-methylanilino)prop-2-enenitrile.
Chemical Property Profile of 2-[4-(3-Fluoropropoxy)phenyl]-3-(4-methylanilino)prop-2-enenitrile
Property Insights of 2-[4-(3-Fluoropropoxy)phenyl]-3-(4-methylanilino)prop-2-enenitrile
The XLogP value of 4.71 indicates that 2-[4-(3-Fluoropropoxy)phenyl]-3-(4-methylanilino)prop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.05 Ų, 2-[4-(3-Fluoropropoxy)phenyl]-3-(4-methylanilino)prop-2-enenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[4-(3-Fluoropropoxy)phenyl]-3-(4-methylanilino)prop-2-enenitrile 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 2-[4-(3-Fluoropropoxy)phenyl]-3-(4-methylanilino)prop-2-enenitrile?
The CAS number of 2-[4-(3-Fluoropropoxy)phenyl]-3-(4-methylanilino)prop-2-enenitrile is 1164536-11-1.
What is the molecular formula of 2-[4-(3-Fluoropropoxy)phenyl]-3-(4-methylanilino)prop-2-enenitrile?
The molecular formula of 2-[4-(3-Fluoropropoxy)phenyl]-3-(4-methylanilino)prop-2-enenitrile is C19H19FN2O.
What is the molecular weight of 2-[4-(3-Fluoropropoxy)phenyl]-3-(4-methylanilino)prop-2-enenitrile?
The molecular weight of 2-[4-(3-Fluoropropoxy)phenyl]-3-(4-methylanilino)prop-2-enenitrile is 310.15 g/mol.
Where can I buy 2-[4-(3-Fluoropropoxy)phenyl]-3-(4-methylanilino)prop-2-enenitrile?
You can request a quote for 2-[4-(3-Fluoropropoxy)phenyl]-3-(4-methylanilino)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 2-[4-(3-Fluoropropoxy)phenyl]-3-(4-methylanilino)prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(3-Fluoropropoxy)phenyl]-3-(4-methylanilino)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.