Basic information
- Standard SMILES
Cn1c(Nc2cc(CNC(=O)OC(C)(C)C)ccc2Cl)nc2cc(Cl)c(N3CCCC(C(F)(F)F)C3)cc21- InChIKey
MQYDNLSIZBWRMF-UHFFFAOYSA-N- Molecular formula
- C26H30Cl2F3N5O2
- Average molar mass
- 572.4 g/mol
Names & identifiers
- Preferred name
- Tert-butyl N-{4-chloro-3-[5-chloro-1-methyl-6-(3-(trifluoromethyl)piperidin-1-yl)-1H-benzo[d]imidazol-2-ylamino]benzyl}-carbamate
- IUPAC
- tert-butyl N-[[4-chloro-3-[[5-chloro-1-methyl-6-[3-(trifluoromethyl)piperidin-1-yl]benzimidazol-2-yl]amino]phenyl]methyl]carbamate
Names & synonyms
Tert-butyl N-{4-chloro-3-[5-chloro-1-methyl-6-(3-(trifluoromethyl)piperidin-1-yl)-1H-benzo[d]imidazol-2-ylamino]benzyl}-carbamateSCHEMBL9900763
Database identifiers
- PubChem CID
- 67958331
Properties
Computed structural properties
- XLogP
- 7.1
- Topological polar surface area
- 71.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 817
Related reactions
3 records
Compound notes
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