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Basic information
- Standard SMILES
Nc1ncc(N2C[C@@H]3CCC(=O)[C@@H]3C2)nc1-c1nnc(-c2ccccc2)o1- InChIKey
RIQHTMOJUPMELN-QWHCGFSZSA-N- Molecular formula
- C19H18N6O2
- Average molar mass
- 362.4 g/mol
Names & identifiers
- Preferred name
- (3aR,6aS)-2-[5-amino-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]-1,3,3a,4,5,6a-hexahydrocyclopenta[c]pyrrol-6-one
- IUPAC
- (3aS,6aR)-2-[5-amino-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]-1,3,3a,5,6,6a-hexahydrocyclopenta[c]pyrrol-4-one
Names & synonyms
SCHEMBL615626RIQHTMOJUPMELN-QWHCGFSZSA-N(3 aR,6aS)-2-[5-amino-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]-1,3,3a,4,5,6a-hexahydrocyclopenta[c]pyrrol-6-one(3aR,6aS)-2-[5-amino-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]-1,3,3a,4,5,6a-hexahydrocyclopenta[c]pyrrol-6-one
Database identifiers
- PubChem CID
- 66744591
Properties
Computed structural propertiesFilling in
- XLogP
- 1
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 556
Related reactions
1 records
Compound notes
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