3-chloro-N-(4-fluorobenzyl)-4-(morpholin-4-yl)aniline
TL;DR: 3-chloro-N-(4-fluorobenzyl)-4-(morpholin-4-yl)aniline (CAS 878713-79-2) is a chemical compound with molecular formula C17H18ClFN2O and molecular weight 320.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[(4-fluorophenyl)methyl]-4-morpholin-4-ylaniline
Also Known As: ASN 12414754, 3-chloro-N-(4-fluorobenzyl)-4-(morpholin-4-yl)aniline, AN-465/14528889, (3-Chloro-4-morpholin-4-yl-phenyl)-(4-fluoro-benzyl)-amine, 3-chloro-N-[(4-fluorophenyl)methyl]-4-morpholin-4-ylaniline
| Molecular Formula | C17H18ClFN2O |
|---|---|
| Molecular Weight | 320.11 g/mol |
| LogP | 3.9278 |
| Topological Polar Surface Area | 24.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 320.10916 |
| Heavy Atoms | 22 |
| Complexity | 627.0561 |
Chemical Identifiers
| CAS Number | 878713-79-2 |
|---|---|
| SMILES | C1COCCN1C2=C(C=C(C=C2)NCC3=CC=C(C=C3)F)Cl |
Product Overview
3-chloro-N-(4-fluorobenzyl)-4-(morpholin-4-yl)aniline (CAS 878713-79-2), with molecular formula C17H18ClFN2O and molecular weight 320.11 g/mol. IUPAC: 3-chloro-N-[(4-fluorophenyl)methyl]-4-morpholin-4-ylaniline.
Chemical Property Profile of 3-chloro-N-(4-fluorobenzyl)-4-(morpholin-4-yl)aniline
Property Insights of 3-chloro-N-(4-fluorobenzyl)-4-(morpholin-4-yl)aniline
The XLogP value of 3.9278 indicates that 3-chloro-N-(4-fluorobenzyl)-4-(morpholin-4-yl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.5 Ų, 3-chloro-N-(4-fluorobenzyl)-4-(morpholin-4-yl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-chloro-N-(4-fluorobenzyl)-4-(morpholin-4-yl)aniline 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-chloro-N-(4-fluorobenzyl)-4-(morpholin-4-yl)aniline?
The CAS number of 3-chloro-N-(4-fluorobenzyl)-4-(morpholin-4-yl)aniline is 878713-79-2.
What is the molecular formula of 3-chloro-N-(4-fluorobenzyl)-4-(morpholin-4-yl)aniline?
The molecular formula of 3-chloro-N-(4-fluorobenzyl)-4-(morpholin-4-yl)aniline is C17H18ClFN2O.
What is the molecular weight of 3-chloro-N-(4-fluorobenzyl)-4-(morpholin-4-yl)aniline?
The molecular weight of 3-chloro-N-(4-fluorobenzyl)-4-(morpholin-4-yl)aniline is 320.11 g/mol.
Where can I buy 3-chloro-N-(4-fluorobenzyl)-4-(morpholin-4-yl)aniline?
You can request a quote for 3-chloro-N-(4-fluorobenzyl)-4-(morpholin-4-yl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-N-(4-fluorobenzyl)-4-(morpholin-4-yl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-N-(4-fluorobenzyl)-4-(morpholin-4-yl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.