A2264/0095379
TL;DR: A2264/0095379 (CAS 299922-58-0) is a chemical compound with molecular formula C19H17F6N3O and molecular weight 417.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-1-(2-methoxyphenyl)-4,4-bis(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Also Known As: A2264/0095379, 2-amino-1-(2-methoxyphenyl)-4,4-bis(trifluoromethyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile, 2-Amino-1-(2-methoxyphenyl)-4,4-bis(trifluoromethyl)-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile #, 2-amino-1-(2-methoxyphenyl)-4,4-bis(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile, 2-amino-4,4-bis(trifluoromethyl)-1-(2-methoxyphenyl)-1,4,5,6,7,8-hexahydroquin oline-3-carbonitrile
| Molecular Formula | C19H17F6N3O |
|---|---|
| Molecular Weight | 417.13 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 62.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 2 |
| Exact Mass | 417.1276 |
| Heavy Atoms | 29 |
| Complexity | 759.0 |
Chemical Identifiers
| CAS Number | 299922-58-0 |
|---|---|
| SMILES | COC1=CC=CC=C1N2C3=C(CCCC3)C(C(=C2N)C#N)(C(F)(F)F)C(F)(F)F |
| InChIKey | NMHYJSQFVFUCPF-UHFFFAOYSA-N |
Product Overview
A2264/0095379 (CAS 299922-58-0), with molecular formula C19H17F6N3O and molecular weight 417.13 g/mol. IUPAC: 2-amino-1-(2-methoxyphenyl)-4,4-bis(trifluoromethyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile.
Chemical Property Profile of A2264/0095379
Property Insights of A2264/0095379
The XLogP value of 5.2 indicates that A2264/0095379 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.3 Ų falls within the moderate polarity range, balancing permeability and solubility for A2264/0095379. Following Lipinski's Rule of Five, A2264/0095379 has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A2264/0095379?
The CAS number of A2264/0095379 is 299922-58-0.
What is the molecular formula of A2264/0095379?
The molecular formula of A2264/0095379 is C19H17F6N3O.
What is the molecular weight of A2264/0095379?
The molecular weight of A2264/0095379 is 417.13 g/mol.
Where can I buy A2264/0095379?
You can request a quote for A2264/0095379 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2264/0095379?
Yes, KEHONG BIO provides custom synthesis services for A2264/0095379 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.