2-(1,2-Dihydro-3H-pyrazol-3-ylidene)-N-phenyl-2H-indole-6-carboxamide
Basic information
- CAS
827317-70-4- Standard SMILES
O=C(Nc1ccccc1)c1ccc2cc(-c3ccn[nH]3)[nH]c2c1- InChIKey
MYAYGNDIKADPQJ-UHFFFAOYSA-N- Molecular formula
- C18H14N4O
- Average molar mass
- 302.3 g/mol
- Monoisotopic mass
- 302.11676108
Names & identifiers
- Preferred name
- 2-(1,2-Dihydro-3H-pyrazol-3-ylidene)-N-phenyl-2H-indole-6-carboxamide
- IUPAC
- N-phenyl-2-(1H-pyrazol-5-yl)-1H-indole-6-carboxamide
Names & synonyms
827317-70-4SCHEMBL5754385DTXSID207408102-(1,2-Dihydro-3H-pyrazol-3-ylidene)-N-phenyl-2H-indole-6-carboxamide
Database identifiers
- CAS
827317-70-4- PubChem CID
- 136235136
- DTXSID
DTXSID20740810
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 73.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 423
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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