Basic information
- Standard SMILES
CC(C)N1CCN(C(=O)c2ccc3c(c2)cc(C(=O)N2CCN(S(=O)(=O)C4CC4)CC2)n3-c2cccc(Cl)c2)CC1- InChIKey
PXOKDFYVXJKDMW-UHFFFAOYSA-N- Molecular formula
- C30H36ClN5O4S
- Average molar mass
- 598.2 g/mol
Names & identifiers
- Preferred name
- [1-(3-Chloro-phenyl)-5-(4-isopropyl-piperazine-1-carbonyl)-1H-indol-2-yl]-(4-cyclopropanesulfonyl-piperazin-1-yl)-methanone
- IUPAC
- [1-(3-chlorophenyl)-2-(4-cyclopropylsulfonylpiperazine-1-carbonyl)indol-5-yl]-(4-propan-2-ylpiperazin-1-yl)methanone
Names & synonyms
SCHEMBL3166435PXOKDFYVXJKDMW-UHFFFAOYSA-N[1-(3-Chloro-phenyl)-5-(4-isopropyl-piperazine-1-carbonyl)-1H-indol-2-yl]-(4-cyclopropanesulfonyl-piperazin-1-yl)-methanone
Database identifiers
- PubChem CID
- 68535689
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 94.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 1,070
Related reactions
1 records
Compound notes
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