Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCC(c2nc(Cl)c(Cl)[nH]2)CC1- InChIKey
XDDVAHSPEWODOA-UHFFFAOYSA-N- Molecular formula
- C13H19Cl2N3O2
- Average molar mass
- 320.21 g/mol
Names & identifiers
- Preferred name
- tert-butyl 4-(4,5-dichloro-1H-imidazol-2-yl)piperidine-1-carboxylate
- IUPAC
- tert-butyl 4-(4,5-dichloro-1H-imidazol-2-yl)piperidine-1-carboxylate
Names & synonyms
SCHEMBL1662358XDDVAHSPEWODOA-UHFFFAOYSA-Ntert-butyl 4-(4,5-dichloro-1H-imidazol-2-yl)piperidine-1-carboxylate
Database identifiers
- PubChem CID
- 67112013
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 354
Related reactions
1 records
Compound notes
Loading…