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N-[2-(Trifluoromethyl)phenyl]-1-adamantanecarboxamide
TL;DR: N-[2-(Trifluoromethyl)phenyl]-1-adamantanecarboxamide (CAS 314055-04-4) is a chemical compound with molecular formula C18H20F3NO and molecular weight 323.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(trifluoromethyl)phenyl]adamantane-1-carboxamide
Also Known As: BAS 00744713, BIM-0015222.P001, AB01223595-03, N-[2-(Trifluoromethyl)phenyl]-1-adamantanecarboxamide, N-[2-(trifluoromethyl)phenyl]adamantane-1-carboxamide
| Molecular Formula | C18H20F3NO |
|---|---|
| Molecular Weight | 323.15 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 323.1497 |
| Heavy Atoms | 23 |
| Complexity | 446.0 |
Chemical Identifiers
| CAS Number | 314055-04-4 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)C(=O)NC4=CC=CC=C4C(F)(F)F |
| InChIKey | DSSLCEYJQQSHEG-UHFFFAOYSA-N |
Product Overview
N-[2-(Trifluoromethyl)phenyl]-1-adamantanecarboxamide (CAS 314055-04-4), with molecular formula C18H20F3NO and molecular weight 323.15 g/mol. IUPAC: N-[2-(trifluoromethyl)phenyl]adamantane-1-carboxamide.
Chemical Property Profile of N-[2-(Trifluoromethyl)phenyl]-1-adamantanecarboxamide
Property Insights of N-[2-(Trifluoromethyl)phenyl]-1-adamantanecarboxamide
The XLogP value of 3.7 indicates that N-[2-(Trifluoromethyl)phenyl]-1-adamantanecarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, N-[2-(Trifluoromethyl)phenyl]-1-adamantanecarboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[2-(Trifluoromethyl)phenyl]-1-adamantanecarboxamide 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 N-[2-(Trifluoromethyl)phenyl]-1-adamantanecarboxamide?
The CAS number of N-[2-(Trifluoromethyl)phenyl]-1-adamantanecarboxamide is 314055-04-4.
What is the molecular formula of N-[2-(Trifluoromethyl)phenyl]-1-adamantanecarboxamide?
The molecular formula of N-[2-(Trifluoromethyl)phenyl]-1-adamantanecarboxamide is C18H20F3NO.
What is the molecular weight of N-[2-(Trifluoromethyl)phenyl]-1-adamantanecarboxamide?
The molecular weight of N-[2-(Trifluoromethyl)phenyl]-1-adamantanecarboxamide is 323.15 g/mol.
Where can I buy N-[2-(Trifluoromethyl)phenyl]-1-adamantanecarboxamide?
You can request a quote for N-[2-(Trifluoromethyl)phenyl]-1-adamantanecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(Trifluoromethyl)phenyl]-1-adamantanecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(Trifluoromethyl)phenyl]-1-adamantanecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.