Mdl 27777
TL;DR: Mdl 27777 (CAS 130835-44-8) is a chemical compound with molecular formula C18H18F3NO and molecular weight 321.13406 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-[4-(trifluoromethyl)phenoxy]methanamine
Also Known As: Mdl 27777, Mdl 27777A, Mdl 27,777, 2,3-Dihydro-2-((methylamino)methyl)-1-(4-(trifluoromethyl)phenoxy)-1H-indene hydrochloride, 1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-[4-(trifluoromethyl)phenoxy]methanamine
Technical Specifications
| Molecular Formula | C18H18F3NO |
| Molecular Weight | 321.13406 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 21.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 321.13406 Da |
| Heavy Atoms | 23 |
| Complexity | 365.0 |
| SMILES | CNC(C1CC2=CC=CC=C2C1)OC3=CC=C(C=C3)C(F)(F)F |
| InChIKey | TTZPGMVKNPCJMZ-UHFFFAOYSA-N |
Chemical Property Profile of Mdl 27777
Property Insights of Mdl 27777
The XLogP value of 4.8 indicates that Mdl 27777 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.3 Ų, Mdl 27777 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Mdl 27777 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Mdl 27777?
The CAS number of Mdl 27777 is 130835-44-8.
What is the molecular formula of Mdl 27777?
The molecular formula of Mdl 27777 is C18H18F3NO.
What is the molecular weight of Mdl 27777?
The molecular weight of Mdl 27777 is 321.13406 g/mol.
Where can I buy Mdl 27777?
You can request a quote for Mdl 27777 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Mdl 27777?
Yes, CoreyChem provides custom synthesis services for Mdl 27777 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.