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Basic information
- Standard SMILES
CCS(=O)(=O)N1CCC(c2c[nH]c3c(C(N)=O)cc(-c4cncc(CN(C)C)c4)cc23)CC1- InChIKey
VDIJWQZUJJNVOW-UHFFFAOYSA-N- Molecular formula
- C24H31N5O3S
- Average molar mass
- 469.6 g/mol
Names & identifiers
- Preferred name
- 5-{5-[(dimethylamino)methyl]-3-pyridinyl}-3-[1-(ethylsulfonyl)-4-piperidinyl]-1H-indole-7-carboxamide
- IUPAC
- 5-[5-[(dimethylamino)methyl]-3-pyridinyl]-3-(1-ethylsulfonylpiperidin-4-yl)-1H-indole-7-carboxamide
Names & synonyms
SCHEMBL552308VDIJWQZUJJNVOW-UHFFFAOYSA-N5-{5-[(dimethylamino)methyl]-3-pyridinyl}-3-[1-(ethylsulfonyl)-4-piperidinyl]-1H-indole-7-carboxamide
Database identifiers
- PubChem CID
- 57732782
Properties
Computed structural propertiesFilling in
- XLogP
- 1.5
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 777
Related reactions
3 records
Compound notes
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