5-chloro-2-methyl-3-[[1-[2-(1H-pyrrol-1-yl)ethyl]piperidin-4-yl]thio]-1H-indole
Basic information
- Standard SMILES
Cc1[nH]c2ccc(Cl)cc2c1SC1CCN(CCn2cccc2)CC1- InChIKey
DLXYDCPWKCZAAO-UHFFFAOYSA-N- Molecular formula
- C20H24ClN3S
- Average molar mass
- 373.9 g/mol
Names & identifiers
- Preferred name
- 5-chloro-2-methyl-3-[[1-[2-(1H-pyrrol-1-yl)ethyl]piperidin-4-yl]thio]-1H-indole
- IUPAC
- 5-chloro-2-methyl-3-[1-(2-pyrrol-1-ylethyl)piperidin-4-yl]sulfanyl-1H-indole
Names & synonyms
SCHEMBL9030450DLXYDCPWKCZAAO-UHFFFAOYSA-N5-chloro-2-methyl -3-[[1-[2-(1H-pyrrol-1-yl)ethyl]piperidin-4-yl]thio]-1H-indole5-chloro-2-methyl-3-[[1-[2-(1H-pyrrol-1-yl)ethyl]piperidin-4-yl]thio]-1H-indole
Database identifiers
- PubChem CID
- 19936622
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 49.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 423
Related reactions
3 records
Compound notes
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