Basic information
- Standard SMILES
CC(C)(Cc1c[nH]c2c(-c3ccc(C(N)=O)cc3)cccc12)NC(=O)OC(C)(C)C- InChIKey
KPDZINLZAJOVON-UHFFFAOYSA-N- Molecular formula
- C24H29N3O3
- Average molar mass
- 407.5 g/mol
Names & identifiers
- Preferred name
- {2-[7-(4-carbamoyl-phenyl)-1H-indol-3-yl]-1,1-dimethyl-ethyl}-carbamic acid tert-butyl ester
- IUPAC
- tert-butyl N-[1-[7-(4-carbamoylphenyl)-1H-indol-3-yl]-2-methylpropan-2-yl]carbamate
Names & synonyms
SCHEMBL5646251KPDZINLZAJOVON-UHFFFAOYSA-N{2-[7-(4-carbamoyl-phenyl)-1H-indol-3-yl]-1,1-dimethyl-ethyl}-carbamic acid tert-butyl ester
Database identifiers
- PubChem CID
- 69517685
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 97.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 620
Related reactions
5 records
Linked notes
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