Basic information
- Standard SMILES
CC(C)(C)c1cc(NC(=O)Oc2ccccc2)n(-c2ccccc2)n1.NC(=O)O- InChIKey
IFTBIYOVNWPXJC-UHFFFAOYSA-N- Molecular formula
- C21H24N4O4
- Average molar mass
- 396.4 g/mol
Names & identifiers
- Preferred name
- carbamate phenyl 3-tert-butyl-1-phenyl-1H-pyrazol-5-ylcarbamate
- IUPAC
- carbamic acid;phenyl N-(3-tert-butyl-1-phenylpyrazol-5-yl)carbamate
Names & synonyms
SCHEMBL1780358IFTBIYOVNWPXJC-UHFFFAOYSA-Ncarbamate phenyl 3-tert-butyl-1-phenyl-1H-pyrazol-5-ylcarbamate
Database identifiers
- PubChem CID
- 67158949
Properties
Computed structural properties
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 470
Related reactions
3 records
Compound notes
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