Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
CC(C)S(=O)(=O)N1CCC(c2c[nH]c3c(C(N)=O)cc(-c4csc(CN(C)CCO)c4)cc23)CC1- InChIKey
JFSYPZQPTATXNX-UHFFFAOYSA-N- Molecular formula
- C25H34N4O4S2
- Average molar mass
- 518.7 g/mol
Names & identifiers
- Preferred name
- 5-(5-{[(2-hydroxyethyl)(methyl)amino]methyl}-3-thienyl)-3-{1-[(1-methylethyl)sulfonyl]-4-piperidinyl}-1H-indole-7-carboxamide
- IUPAC
- 5-[5-[[2-hydroxyethyl(methyl)amino]methyl]thiophen-3-yl]-3-(1-propan-2-ylsulfonylpiperidin-4-yl)-1H-indole-7-carboxamide
Names & synonyms
SCHEMBL552364JFSYPZQPTATXNX-UHFFFAOYSA-N5-(5-{[(2-hydroxyethyl)(methyl)amino]methyl}-3-thienyl)-3-{1-[(1-methylethyl)sulfonyl]-4-piperidinyl}-1H-indole-7-carboxamide
Database identifiers
- PubChem CID
- 57732685
Properties
Computed structural propertiesFilling in
- XLogP
- 2
- Topological polar surface area
- 156 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 828
Related reactions
2 records
Compound notes
Loading…