Basic information
- CAS
72570-56-0- Standard SMILES
Cc1cc(=O)n2c(c1)[nH]c1ccccc12- InChIKey
KDKAHQMQJQPBNF-UHFFFAOYSA-N- Molecular formula
- C12H10N2O
- Average molar mass
- 198.22 g/mol
- Monoisotopic mass
- 198.07931295
Names & identifiers
- Preferred name
- 3-Methylpyrido[1,2-a]benzimidazol-1(5H)-one
- IUPAC
- 3-methyl-5H-pyrido[1,2-a]benzimidazol-1-one
- English name
- Pyrido[1,2-a]benzimidazol-1(5H)-one, 3-methyl- (9CI)
- Molecular formula
- C12H10N2O
- Molecular weight
- 198.22
Names & synonyms
72570-56-03-methyl-5H-pyrido[1,2-a]benzimidazol-1-one3-Methylpyrido[1,2-a]benzimidazol-1(5H)-oneNSC355132SCHEMBL2182908DTXSID30320107NSC-3551323-methyl-Pyrido[1,2-a]benzimidazol-1(5H)-one3-Methylpyrido[1,2-a][1,3]benzimidazol-1(5H)-onePyrido[1,2-a]benzimidazol-1(5H)-one, 3-methyl-Pyrido[1,2-a]benzimidazol-1(5H)-one, 3-methyl- (9CI)
Database identifiers
- CAS
72570-56-0- PubChem CID
- 337362
- DTXSID
DTXSID30320107
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 370
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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