Basic information
- CAS
122062-47-9- Standard SMILES
N#Cc1c2c(c(N3CCOCC3)n3c1nc1ccccc13)CCC2- InChIKey
PKNJUWQZBNJAOP-UHFFFAOYSA-N- Molecular formula
- C19H18N4O
- Average molar mass
- 318.4 g/mol
- Monoisotopic mass
- 318.14806121
Names & identifiers
- Preferred name
- 11-(4-morpholinyl)-2,3-dihydro-1H-cyclopenta[4,5]pyrido[1,2-a]benzimidazole-4-carbonitrile
- IUPAC
- 16-morpholin-4-yl-1,8-diazatetracyclo[7.7.0.02,7.011,15]hexadeca-2,4,6,8,10,15-hexaene-10-carbonitrile
- English name
- 11-(4-morpholinyl)-2,3-dihydro-1H-cyclopenta[4,5]pyrido[1,2-a]benzimidazole-4-carbonitrile
- Molecular formula
- C19H18N4O
- Molecular weight
- 318.37
Names & synonyms
11-(4-morpholinyl)-2,3-dihydro-1H-cyclopenta[4,5]pyrido[1,2-a]benzimidazole-4-carbonitrile122062-47-911-(morpholin-4-yl)-2,3-dihydro-1H-cyclopenta[4,5]pyrido[1,2-a]benzimidazole-4-carbonitrileChemDiv1_021805Oprea1_143010Oprea1_605882HMS648P03SMSF0009087STK103204AKOS000542699CB00465CCG-106667
Show more names
1H-Cyclopenta[4,5]pyrido[1,2-a]benzimidazole-4-carbonitrile, 2,3-dihydro-11-(4-morpholinyl)-
16-morpholin-4-yl-1,8-diazatetracyclo[7.7.0.02,7.011,15]hexadeca-2,4,6,8,10,15-hexaene-10-carbonitrileEU-0005063ST50222195UNM000000551501AB00100156-01AF-399/36011053SR-01000433889SR-01000433889-1
Database identifiers
- CAS
122062-47-9- PubChem CID
- 726772
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 53.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 525
Chemistry & industry
Suppliers5 total
PHARMEKS Ltd.[email protected]
Interbioscreen Ltd.[email protected]
OTAVA-BB[email protected]
SPECS[email protected]
VITAS-BB—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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