Basic information
- Standard SMILES
CC1CCN(C(=O)c2cc3cc(C(=O)N4CCN(C(C)C)CC4)ccc3[nH]2)CC1- InChIKey
RZPFXHDQZKBRTI-UHFFFAOYSA-N- Molecular formula
- C23H32N4O2
- Average molar mass
- 396.5 g/mol
- Monoisotopic mass
- 396.25252628
Names & identifiers
- Preferred name
- [5-(4-Isopropyl-piperazine-1-carbonyl)-1H-indol-2-yl]-(4-methyl-piperidin-1-yl)-methanone
- IUPAC
- [2-(4-methylpiperidine-1-carbonyl)-1H-indol-5-yl]-(4-propan-2-ylpiperazin-1-yl)methanone
Names & synonyms
SCHEMBL3535196RZPFXHDQZKBRTI-UHFFFAOYSA-N[5-(4-Isopropyl-piperazine-1-carbonyl)-1H-indol-2-yl]-(4-methyl-piperidin-1-yl)-methanone
Database identifiers
- PubChem CID
- 68680243
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 59.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 594
Related reactions
3 records
Compound notes
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