(3S,9aR)-8-(3-fluorobenzoyl)-3-methyl-hexahydropyrazino[1,2-a]piperazine-1,4-dione
AlkaPlorer ID: AK365286
Synonym: None
IUPAC Name: 2-(3-fluorobenzoyl)-7-methyl-1,3,4,7,8,9a-hexahydropyrazino[1,2-a]pyrazine-6,9-dione
Structure
SMILES: CC1NC(=O)C2CN(C(=O)C3=CC=CC(F)=C3)CCN2C1=O
InChI: InChI=1S/C15H16FN3O3/c1-9-14(21)19-6-5-18(8-12(19)13(20)17-9)15(22)10-3-2-4-11(16)7-10/h2-4,7,9,12H,5-6,8H2,1H3,(H,17,20)
InChIKey: DHPIUQMVBWYWAX-UHFFFAOYSA-N
Source
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Properties Information
Molecule Weight: 305.3090000000001
TPSA？: 69.72
MolLogP？: -0.0029999999999998
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 3
Activities Information
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