3-[[(8aR)-1,4-dioxo-6,7,8,8a-tetrahydro-3H-pyrrolo[1,2-a]pyrazin-2-yl]methyl]-4-methoxy-N-(2-phenylethyl)benzamide
AlkaPlorer ID: AK508637
Synonym: None
IUPAC Name: 3-[[(8aR)-1,4-dioxo-6,7,8,8a-tetrahydro-3H-pyrrolo[1,2-a]pyrazin-2-yl]methyl]-4-methoxy-N-(2-phenylethyl)benzamide
Structure
SMILES: COC1=CC=C(C(=O)NCCC2=CC=CC=C2)C=C1CN1CC(=O)N2CCC[C@@H]2C1=O
InChI: InChI=1S/C24H27N3O4/c1-31-21-10-9-18(23(29)25-12-11-17-6-3-2-4-7-17)14-19(21)15-26-16-22(28)27-13-5-8-20(27)24(26)30/h2-4,6-7,9-10,14,20H,5,8,11-13,15-16H2,1H3,(H,25,29)/t20-/m1/s1
InChIKey: RCBNLMTVNZLATF-HXUWFJFHSA-N
Source
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Properties Information
Molecule Weight: 421.4970000000003
TPSA？: 78.95
MolLogP？: 2.0009
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 4
Activities Information
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