Basic information
- Standard SMILES
CCS(=O)(=O)N1CCC(c2c[nH]c3c(C(N)=O)cc(-c4ccc(CNCCCOC)s4)cc23)CC1- InChIKey
ZFWMAADPWHRDQH-UHFFFAOYSA-N- Molecular formula
- C25H34N4O4S2
- Average molar mass
- 518.7 g/mol
Names & identifiers
- Preferred name
- 3-[1-(ethylsulfonyl)-4-piperidinyl]-5-[5-({[3-(methyloxy)propyl]amino}methyl)-2-thienyl]-1H-indole-7-carboxamide
- IUPAC
- 3-(1-ethylsulfonylpiperidin-4-yl)-5-[5-[(3-methoxypropylamino)methyl]thiophen-2-yl]-1H-indole-7-carboxamide
Names & synonyms
SCHEMBL552327ZFWMAADPWHRDQH-UHFFFAOYSA-N3-[1-(ethylsulfonyl)-4-piperidinyl]-5-[5-({[3-(methyloxy)propyl]amino}methyl)-2-thienyl]-1H-indole-7-carboxamide
Database identifiers
- PubChem CID
- 57732762
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 154 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 11
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 800
Related reactions
3 records
Compound notes
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