Basic information
- Standard SMILES
Cc1[nH]c(/C=C2\C(=O)Nc3ccc(S(=O)(=O)Cc4c(Cl)cccc4Cl)cc32)c(C)c1CCC(=O)N1CCC(NC2CC2)CC1- InChIKey
WRMRTUJSJYOCQY-ONUIUJJFSA-N- Molecular formula
- C33H36Cl2N4O4S
- Average molar mass
- 655.6 g/mol
Names & identifiers
- Preferred name
- 3-[1-{4-[3-(4-Cyclopropylamino-piperidin-1-yl)-3-oxo-propyl]-3,5-dimethyl-1h-pyrrol-2-yl}-meth-(z)-ylidene]-5-(2,6-dichloro-phenylmethanesulfonyl)-1,3-dihydro-indol-2-one
- IUPAC
- (3Z)-3-[[4-[3-[4-(cyclopropylamino)piperidin-1-yl]-3-oxopropyl]-3,5-dimethyl-1H-pyrrol-2-yl]methylidene]-5-[(2,6-dichlorophenyl)methylsulfonyl]-1H-indol-2-one
Names & synonyms
SCHEMBL143798WRMRTUJSJYOCQY-ONUIUJJFSA-N3-[1-{4-[3-(4-cyclopropylamino-piperidin-1-yl)-3-oxo-propyl]-3,5-dimethyl-1h-pyrrol-2-yl}-meth-(z)-ylidene]-5-(2,6-dichloro-phenylmethanesulfonyl)-1,3-dihydro-indol-2-one
Database identifiers
- PubChem CID
- 59077752
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 120 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 1,190
Related reactions
1 records
Compound notes
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