(Z)-8-[(3-methoxy-1H-pyrrol-2-yl)methylene]-3,6,7,8-tetrahydro-pyrrolo-[3,2-e]benzimidazol-7-one

HCID 9795685
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Basic information

Standard SMILES
COc1cc[nH]c1/C=C1\C(=O)Nc2ccc3[nH]cnc3c21
InChIKey
PEPBZVVSLBAQFM-VURMDHGXSA-N
Molecular formula
C15H12N4O2
Average molar mass
280.28 g/mol
Monoisotopic mass
280.09602564

Names & identifiers

Preferred name
(Z)-8-[(3-methoxy-1H-pyrrol-2-yl)methylene]-3,6,7,8-tetrahydro-pyrrolo-[3,2-e]benzimidazol-7-one
IUPAC
(8Z)-8-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-3,6-dihydropyrrolo[3,2-e]benzimidazol-7-one

Names & synonyms

SCHEMBL6993615PEPBZVVSLBAQFM-VURMDHGXSA-N(Z)-8-[(3-methoxy-1H-pyrrol-2-yl)methylene]-3,6,7,8-tetrahydro-pyrrolo-[3,2-e]benzimidazol-7-one

Database identifiers

PubChem CID
9795685

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
82.8 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
21

Related reactions

2 records
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Compound notes

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