Basic information
- Standard SMILES
CC1(C)C2CC(CNc3ccc(S(=O)(=O)NCC4CC4)c(C(F)(F)F)c3)CC1C2- InChIKey
HJQAPSQQASGABR-UHFFFAOYSA-N- Molecular formula
- C21H29F3N2O2S
- Average molar mass
- 430.5 g/mol
Names & identifiers
- Preferred name
- n-Cyclopropylmethyl-4-[(6,6-dimethyl-bicyclo[3.1.1]hept-3-ylmethyl)-amino]-2-trifluoromethyl-benzenesulfonamide
- IUPAC
- N-(cyclopropylmethyl)-4-[(6,6-dimethyl-3-bicyclo[3.1.1]heptanyl)methylamino]-2-(trifluoromethyl)benzenesulfonamide
Names & synonyms
n-cyclopropylmethyl-4-[(6,6-dimethyl-bicyclo[3.1.1]hept-3-ylmethyl)-amino]-2-trifluoromethyl-benzenesulfonamideSCHEMBL3131224
Database identifiers
- PubChem CID
- 68522976
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 66.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 686
Related reactions
1 records
Compound notes
Loading…