Basic information
- CAS
130946-66-6- Standard SMILES
Cc1nn(-c2cc(C)c3cc(Cl)ccc3n2)c2c1C(=O)c1ccccc1-2- InChIKey
GASPGUMHRVZMLJ-UHFFFAOYSA-N- Molecular formula
- C21H14ClN3O
- Average molar mass
- 359.8 g/mol
- Monoisotopic mass
- 359.0825398
Names & identifiers
- Preferred name
- Indeno(1,2-c)pyrazol-4(1H)-one, 1-(6-chloro-4-methyl-2-quinolinyl)-3-methyl-
- IUPAC
- 1-(6-chloro-4-methylquinolin-2-yl)-3-methylindeno[2,1-d]pyrazol-4-one
Names & synonyms
130946-66-6Indeno(1,2-c)pyrazol-4(1H)-one, 1-(6-chloro-4-methyl-2-quinolinyl)-3-methyl-1-(6-Chloro-4-methyl-2-quinolinyl)-3-methylindeno(1,2-c)pyrazol-4(1H)-oneDTXSID90156803RefChem:349068DTXCID70792941-(6-chloro-4-methylquinolin-2-yl)-3-methylindeno[1,2-c]pyrazol-4(1h)-one
Database identifiers
- CAS
130946-66-6- PubChem CID
- 216352
- DTXSID
DTXSID90156803
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 47.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 571
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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