Basic information
- Standard SMILES
O=C(c1ccc(OCCCCCN2CCC(NC(=O)C(F)(F)F)CC2)cc1)N1CCC(N2C(=O)CCc3ccccc32)CC1- InChIKey
KVJBAVZOBHWOQL-UHFFFAOYSA-N- Molecular formula
- C33H41F3N4O4
- Average molar mass
- 614.7 g/mol
Names & identifiers
- Preferred name
- 1-[1-{4-[5-(4-Trifluoroacetylamino-1-piperidinyl)pentyloxy]benzoyl}-4-piperidinyl]-3,4-dihydrocarbostyril
- IUPAC
- 2,2,2-trifluoro-N-[1-[5-[4-[4-(2-oxo-3,4-dihydroquinolin-1-yl)piperidine-1-carbonyl]phenoxy]pentyl]piperidin-4-yl]acetamide
Names & synonyms
1-[1-{4-[5-(4-trifluoroacetylamino-1-piperidinyl)pentyloxy]benzoyl}-4-piperidinyl]-3,4-dihydrocarbostyrilSCHEMBL7271232L006670
Database identifiers
- PubChem CID
- 18960745
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 82.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 10
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 957
Related reactions
3 records
Compound notes
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