Basic information
- Standard SMILES
CC(C)(C)OC(=O)NC1CCC(C(=O)Nc2cccc(-c3cccc4c3/C(=C/c3ccc[nH]3)C(=O)N4)c2)CC1- InChIKey
XTUVLUCURIVGRF-BWAHOGKJSA-N- Molecular formula
- C31H34N4O4
- Average molar mass
- 526.6 g/mol
Names & identifiers
- Preferred name
- (Z)-[4-[3-[2,3-dihydro-2-oxo-3-[(1H-pyrrol-2-yl)methylene]-1H-indol-4-yl]-phenylcarbamoyl]-cyclohexyl]-carbamic acid tert-butyl ester
- IUPAC
- tert-butyl N-[4-[[3-[(3Z)-2-oxo-3-(1H-pyrrol-2-ylmethylidene)-1H-indol-4-yl]phenyl]carbamoyl]cyclohexyl]carbamate
Names & synonyms
SCHEMBL7830881XTUVLUCURIVGRF-BWAHOGKJSA-N(Z)-[4-[3-[2,3-dihydro-2-oxo-3-[(1H-pyrrol-2-yl)methylene]-1H-indol-4-yl]-phenylcarbamoyl]-cyclohexyl]-carbamic acid tert-butyl ester
Database identifiers
- PubChem CID
- 70201180
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 935
Related reactions
2 records
Compound notes
Loading…