1-{4-[(4-methylphenyl)methyl]-1-oxa-9-azaspiro[5.5]undecan-9-yl}-4-(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)butane-1,4-dione
Chemical Structure Depiction of
1-{4-[(4-methylphenyl)methyl]-1-oxa-9-azaspiro[5.5]undecan-9-yl}-4-(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)butane-1,4-dione
1-{4-[(4-methylphenyl)methyl]-1-oxa-9-azaspiro[5.5]undecan-9-yl}-4-(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)butane-1,4-dione
Compound characteristics
| Compound ID: | T500-1650 |
| Compound Name: | 1-{4-[(4-methylphenyl)methyl]-1-oxa-9-azaspiro[5.5]undecan-9-yl}-4-(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)butane-1,4-dione |
| Molecular Weight: | 489.61 |
| Molecular Formula: | C29 H35 N3 O4 |
| Smiles: | Cc1ccc(CC2CCOC3(CCN(CC3)C(CCC(N3CC(Nc4ccccc34)=O)=O)=O)C2)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5545 |
| logD: | 3.5531 |
| logSw: | -3.6224 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.58 |
| InChI Key: | QFLJFEJVZXJXCY-QHCPKHFHSA-N |