A1466/0064627
TL;DR: A1466/0064627 (CAS 339995-42-5) is a chemical compound with molecular formula C25H22F3N3O and molecular weight 437.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(E)-[2-(trifluoromethyl)phenyl]methylideneamino]benzamide
Also Known As: A1466/0064627, 4-(3,4-dihydro-2(1H)-isoquinolinylmethyl)-N'-[2-(trifluoromethyl)benzylidene]benzohydrazide, 4-(3,4-DIHYDRO-2(1H)-ISOQUINOLINYLMETHYL)-N'-{(E)-[2-(TRIFLUOROMETHYL)PHENYL]METHYLENE}BENZOHYDRAZIDE, 4-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-N'-{(E)-[2-(trifluoromethyl)phenyl]methylidene}benzohydrazide
| Molecular Formula | C25H22F3N3O |
|---|---|
| Molecular Weight | 437.17 g/mol |
| LogP | 5.0276 |
| Topological Polar Surface Area | 44.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 437.1715 |
| Heavy Atoms | 32 |
| Complexity | 1123.7761 |
Chemical Identifiers
| CAS Number | 339995-42-5 |
|---|---|
| SMILES | C1CN(CC2=CC=CC=C21)CC3=CC=C(C=C3)C(=O)N/N=C/C4=CC=CC=C4C(F)(F)F |
Product Overview
A1466/0064627 (CAS 339995-42-5), with molecular formula C25H22F3N3O and molecular weight 437.17 g/mol. IUPAC: 4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-[(E)-[2-(trifluoromethyl)phenyl]methylideneamino]benzamide.
Chemical Property Profile of A1466/0064627
Property Insights of A1466/0064627
The XLogP value of 5.0276 indicates that A1466/0064627 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.7 Ų, A1466/0064627 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A1466/0064627 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A1466/0064627?
The CAS number of A1466/0064627 is 339995-42-5.
What is the molecular formula of A1466/0064627?
The molecular formula of A1466/0064627 is C25H22F3N3O.
What is the molecular weight of A1466/0064627?
The molecular weight of A1466/0064627 is 437.17 g/mol.
Where can I buy A1466/0064627?
You can request a quote for A1466/0064627 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1466/0064627?
Yes, KEHONG BIO provides custom synthesis services for A1466/0064627 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.