Ccris 3687
TL;DR: Ccris 3687 (CAS 126370-97-6) is a chemical compound with molecular formula C22H16F3N and molecular weight 351.12347 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[[2-(trifluoromethyl)phenyl]methyl]-1a,9b-dihydrophenanthro[9,10-b]azirine
Also Known As: 1((3a-Trifluoromethylphenyl)methyl)-1a,9b-dihydro-1H-phenanthro(9,10-b)azirine, 1-((3a-Trifluoromethylphenyl)methyl)-1a,9b-dihydro-1H-phenanthro(9,10-b)azirine, 1a,9b-Dihydro-1-((3-(trifluoromethyl)phenyl)methyl)-1H-phenanthro(9,10-b)azirine, 1-[[2-(trifluoromethyl)phenyl]methyl]-1a,9b-dihydrophenanthro[9,10-b]azirine, 1-{[2-(Trifluoromethyl)phenyl]methyl}-1a,9b-dihydro-1H-phenanthro[9,10-b]azirene
Technical Specifications
| Molecular Formula | C22H16F3N |
| Molecular Weight | 351.12347 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 3.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 351.12347 Da |
| Heavy Atoms | 26 |
| Complexity | 490.0 |
| SMILES | C1=CC=C(C(=C1)CN2C3C2C4=CC=CC=C4C5=CC=CC=C35)C(F)(F)F |
| InChIKey | FCJORCGIWMYYEQ-UHFFFAOYSA-N |
Chemical Property Profile of Ccris 3687
Property Insights of Ccris 3687
The XLogP value of 5.2 indicates that Ccris 3687 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.0 Ų, Ccris 3687 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ccris 3687 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Ccris 3687?
The CAS number of Ccris 3687 is 126370-97-6.
What is the molecular formula of Ccris 3687?
The molecular formula of Ccris 3687 is C22H16F3N.
What is the molecular weight of Ccris 3687?
The molecular weight of Ccris 3687 is 351.12347 g/mol.
Where can I buy Ccris 3687?
You can request a quote for Ccris 3687 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ccris 3687?
Yes, CoreyChem provides custom synthesis services for Ccris 3687 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.