Basic information
- Standard SMILES
CCS(=O)(=O)N1CCC(c2c[nH]c3c(C(N)=O)cc(-c4ccc5c(c4)C(=O)CC5)cc23)CC1- InChIKey
YRNRVRLPEBEDNZ-UHFFFAOYSA-N- Molecular formula
- C25H27N3O4S
- Average molar mass
- 465.6 g/mol
- Monoisotopic mass
- 465.17222752
Names & identifiers
- Preferred name
- 3-[1-(ethylsulfonyl)-4-piperidinyl]-5-(3-oxo-2,3-dihydro-1H-inden-5-yl)-1H-indole-7-carboxamide
- IUPAC
- 3-(1-ethylsulfonylpiperidin-4-yl)-5-(3-oxo-1,2-dihydroinden-5-yl)-1H-indole-7-carboxamide
Names & synonyms
SCHEMBL552519YRNRVRLPEBEDNZ-UHFFFAOYSA-N3-[1-(ethylsulfonyl)-4-piperidinyl]-5-(3-oxo-2,3-dihydro-1H-inden-5-yl)-1H-indole-7-carboxamide
Database identifiers
- PubChem CID
- 66723045
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 122 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 863
Related reactions
3 records
Compound notes
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