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3-methyl-6-(5-methylhexahydropyrrolo[3,4-c]pyrrole-2(1H)-yl)quinazolin-4(3H)-one

HCID 69928688
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CN1CC2CN(c3ccc4ncn(C)c(=O)c4c3)CC2C1
InChIKey
HXURVFNGWGEGCS-UHFFFAOYSA-N
Molecular formula
C16H20N4O
Average molar mass
284.36 g/mol
Monoisotopic mass
284.16371127

Names & identifiers

Preferred name
3-methyl-6-(5-methylhexahydropyrrolo[3,4-c]pyrrole-2(1H)-yl)quinazolin-4(3H)-one
IUPAC
3-methyl-6-(2-methyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl)quinazolin-4-one

Names & synonyms

SCHEMBL6887789HXURVFNGWGEGCS-UHFFFAOYSA-N3-methyl-6-(5-methylhexahydropyrrolo[3,4-c]pyrrole-2(1H)-yl)quinazolin-4(3H)-one

Database identifiers

PubChem CID
69928688

Properties

Computed structural properties

XLogP
0.9
Topological polar surface area
39.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
21
Formal charge
0
Complexity
451

Related reactions

1 records
New reaction record
HRID 77401 reaction equation
HRID 77401As productuspto-grants-2014_09

Compound notes

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