Basic information
- Standard SMILES
CCS(=O)(=O)N1CCC(c2c[nH]c3c(C(N)=O)cc(-c4ccc(CCNC(=O)C5CCC5)cc4)cc23)CC1- InChIKey
UMOKSOBOMWRDLR-UHFFFAOYSA-N- Molecular formula
- C29H36N4O4S
- Average molar mass
- 536.7 g/mol
Names & identifiers
- Preferred name
- 5-(4-{2-[(cyclobutylcarbonyl)amino]ethyl}phenyl)-3-[1-(ethylsulfonyl)-4-piperidinyl]-1H-indole-7-carboxamide
- IUPAC
- 5-[4-[2-(cyclobutanecarbonylamino)ethyl]phenyl]-3-(1-ethylsulfonylpiperidin-4-yl)-1H-indole-7-carboxamide
Names & synonyms
SCHEMBL551990UMOKSOBOMWRDLR-UHFFFAOYSA-N5-(4-{2-[(cyclobutylcarbonyl)amino]ethyl}phenyl)-3-[1-(ethylsulfonyl)-4-piperidinyl]-1H-indole-7-carboxamide
Database identifiers
- PubChem CID
- 57732641
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 134 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 933
Related reactions
2 records
Compound notes
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