3-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)-N-{[4-(4-methoxyphenyl)oxan-4-yl]methyl}propanamide
Chemical Structure Depiction of
3-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)-N-{[4-(4-methoxyphenyl)oxan-4-yl]methyl}propanamide
3-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)-N-{[4-(4-methoxyphenyl)oxan-4-yl]methyl}propanamide
Compound characteristics
| Compound ID: | Y041-6981 |
| Compound Name: | 3-(5,7-dioxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl)-N-{[4-(4-methoxyphenyl)oxan-4-yl]methyl}propanamide |
| Molecular Weight: | 423.47 |
| Molecular Formula: | C23 H25 N3 O5 |
| Smiles: | COc1ccc(cc1)C1(CCOCC1)CNC(CCN1C(c2cccnc2C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.229 |
| logD: | 1.229 |
| logSw: | -1.9855 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.223 |
| InChI Key: | ZJMJODPJUYINRE-UHFFFAOYSA-N |