7G-414S
TL;DR: 7G-414S (CAS 400086-76-2) is a chemical compound with molecular formula C23H20F4N4O and molecular weight 444.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(4-fluorophenyl)piperazin-1-yl]-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide
Also Known As: 7G-414S, 2-[4-(4-fluorophenyl)piperazin-1-yl]-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide, 2-[4-(4-fluorophenyl)piperazino]-N-[3-(trifluoromethyl)phenyl]nicotinamide, 2-(4-(4-Fluorophenyl)piperazin-1-yl)-N-(3-(trifluoromethyl)phenyl)nicotinamide
| Molecular Formula | C23H20F4N4O |
|---|---|
| Molecular Weight | 444.16 g/mol |
| LogP | 4.8184 |
| Topological Polar Surface Area | 48.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 444.15732 |
| Heavy Atoms | 32 |
| Complexity | 1093.6505 |
Chemical Identifiers
| CAS Number | 400086-76-2 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=C(C=C2)F)C3=C(C=CC=N3)C(=O)NC4=CC=CC(=C4)C(F)(F)F |
Product Overview
7G-414S (CAS 400086-76-2), with molecular formula C23H20F4N4O and molecular weight 444.16 g/mol. IUPAC: 2-[4-(4-fluorophenyl)piperazin-1-yl]-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide.
Chemical Property Profile of 7G-414S
Property Insights of 7G-414S
The XLogP value of 4.8184 indicates that 7G-414S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.47 Ų, 7G-414S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7G-414S has 1 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 7G-414S?
The CAS number of 7G-414S is 400086-76-2.
What is the molecular formula of 7G-414S?
The molecular formula of 7G-414S is C23H20F4N4O.
What is the molecular weight of 7G-414S?
The molecular weight of 7G-414S is 444.16 g/mol.
Where can I buy 7G-414S?
You can request a quote for 7G-414S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7G-414S?
Yes, KEHONG BIO provides custom synthesis services for 7G-414S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.