2-(1-Methyl-6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl)acetic acid

HCID 89451654
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Basic information

Standard SMILES
Cc1ccnc2c1n1cccc1c(=O)n2CC(=O)O
InChIKey
WXAOBTJZNMBUTL-UHFFFAOYSA-N
Molecular formula
C13H11N3O3
Average molar mass
257.24 g/mol
Monoisotopic mass
257.08004122

Names & identifiers

Preferred name
2-(1-Methyl-6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl)acetic acid
IUPAC
2-(13-methyl-7-oxo-2,8,10-triazatricyclo[7.4.0.02,6]trideca-1(13),3,5,9,11-pentaen-8-yl)acetic acid

Names & synonyms

SCHEMBL14793348WXAOBTJZNMBUTL-UHFFFAOYSA-N2-(1-Methyl-6-oxopyrido[2,3-e]pyrrolo[1,2-a]pyrazin-5(6H)-yl)acetic acid

Database identifiers

PubChem CID
89451654

Properties

Computed structural properties

XLogP
1
Topological polar surface area
75.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
19

Related reactions

2 records
New reaction record

Compound notes

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