2-[6-oxo-3-(pyrrolidine-1-carbonyl)-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxalin-5-yl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]acetamide
Chemical Structure Depiction of
2-[6-oxo-3-(pyrrolidine-1-carbonyl)-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxalin-5-yl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]acetamide
2-[6-oxo-3-(pyrrolidine-1-carbonyl)-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxalin-5-yl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]acetamide
Compound characteristics
| Compound ID: | G673-0623 |
| Compound Name: | 2-[6-oxo-3-(pyrrolidine-1-carbonyl)-6,6a,7,8,9,10-hexahydro-5H-pyrido[1,2-a]quinoxalin-5-yl]-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]acetamide |
| Molecular Weight: | 478.59 |
| Molecular Formula: | C26 H34 N6 O3 |
| Smiles: | Cc1c(CNC(CN2C(C3CCCCN3c3ccc(cc23)C(N2CCCC2)=O)=O)=O)c(C)n(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9263 |
| logD: | 0.9263 |
| logSw: | -2.3074 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.117 |
| InChI Key: | DIUGSMFXPHAYFV-QFIPXVFZSA-N |