Basic information
- Standard SMILES
C[C@@H]1CCCN1CCCOc1cnc2c(c1)cc1n2CCNC1=O- InChIKey
NOCRTGSVURVAOJ-CYBMUJFWSA-N- Molecular formula
- C18H24N4O2
- Average molar mass
- 328.4 g/mol
- Monoisotopic mass
- 328.18992602
Names & identifiers
- Preferred name
- 7-[3-((R)-2-Methyl-pyrrolidin-1-yl)-propoxy]-3,4-dihydro-2H-2,4a,5-triaza-fluoren-1-one
- IUPAC
- 5-[3-[(2R)-2-methylpyrrolidin-1-yl]propoxy]-1,3,11-triazatricyclo[7.4.0.02,7]trideca-2,4,6,8-tetraen-10-one
Names & synonyms
SCHEMBL2984899NOCRTGSVURVAOJ-CYBMUJFWSA-N7-[3-((R)-2-Methyl-pyrrolidin-1-yl)-propoxy]-3,4-dihydro-2H-2,4a,5-triaza-fluoren-1-one
Database identifiers
- PubChem CID
- 16679031
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 59.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 460
Related reactions
2 records
Compound notes
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