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Basic information
- Standard SMILES
CC(=O)NC1=C(C)C(=O)c2c(nc3n2CCC3O)C1=N- InChIKey
SAZHZLQIWXWAOA-UHFFFAOYSA-N- Molecular formula
- C13H14N4O3
- Average molar mass
- 274.28 g/mol
- Monoisotopic mass
- 274.10659032
Names & identifiers
- Preferred name
- N-(3-hydroxy-5-imino-7-methyl-8-oxo-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-6-yl)acetamide
- IUPAC
- N-(3-hydroxy-5-imino-7-methyl-8-oxo-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-6-yl)acetamide
Names & synonyms
NSC652728CHEMBL275851NSC-652728N-(3-Hydroxy-5-imino-7-methyl-8-oxo-2,3,5,8-tetrahydro-1H-pyrrolo[1,2-a]benzimidazol-6-yl)acetamideN-(3-hydroxy-5-imino-7-methyl-8-oxo-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-6-yl)acetamideNCI60_018440
Database identifiers
- PubChem CID
- 374652
- ChEMBL
CHEMBL275851
Properties
Computed structural propertiesFilling in
- XLogP
- -0.7
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 542
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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