Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCC(NC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C(c2ccc(Cl)c(Cl)c2)C1- InChIKey
LNHDALVAMNZXEU-UHFFFAOYSA-N- Molecular formula
- C25H24Cl2F6N2O3
- Average molar mass
- 585.4 g/mol
Names & identifiers
- Preferred name
- Tert-butyl 4-[[3,5-bis(trifluoromethyl)benzoyl]amino]-3-(3,4-dichlorophenyl)piperidine-1-carboxylate
- IUPAC
- tert-butyl 4-[[3,5-bis(trifluoromethyl)benzoyl]amino]-3-(3,4-dichlorophenyl)piperidine-1-carboxylate
Names & synonyms
SCHEMBL4150434LNHDALVAMNZXEU-UHFFFAOYSA-Ntert-butyl 4-[[3,5-bis(trifluoromethyl)benzoyl]amino]-3-(3,4-dichlorophenyl)piperidine-1-carboxylate
Database identifiers
- PubChem CID
- 57741720
Properties
Computed structural properties
- XLogP
- 7.1
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 5
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 828
Related reactions
1 records
Compound notes
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