Basic information
- Standard SMILES
Cn1cc(-c2c(-c3cc(-c4ccncc4)n[nH]c3=O)[nH]c3ccc(C(=O)NC4CCN(C5CC5)CC4)cc23)cn1- InChIKey
ZZTJGTNEPVNSCC-UHFFFAOYSA-N- Molecular formula
- C30H30N8O2
- Average molar mass
- 534.6 g/mol
- Monoisotopic mass
- 534.24917223
Names & identifiers
- Preferred name
- 3-(1-Methyl-1H-pyrazol-4-yl)-2-(3-oxo-6-pyridin-4-yl-2,3-dihydro-pyridazin-4-yl)-1H-indole-5-carboxylic acid (1-cyclopropyl-piperidin-4-yl)-amide
- IUPAC
- N-(1-cyclopropylpiperidin-4-yl)-3-(1-methylpyrazol-4-yl)-2-(6-oxo-3-pyridin-4-yl-1H-pyridazin-5-yl)-1H-indole-5-carboxamide
Names & synonyms
SCHEMBL13338054ZZTJGTNEPVNSCC-UHFFFAOYSA-N3-(1-Methyl-1H-pyrazol-4-yl)-2-(3-oxo-6-pyridin-4-yl-2,3-dihydro-pyridazin-4-yl)-1H-indole-5-carboxylic acid (1-cyclopropyl-piperidin-4-yl)-amide
Database identifiers
- PubChem CID
- 135961816
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 120 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 1,030
Related reactions
2 records
Compound notes
Loading…