4-amino-N-(2H-1,3-benzodioxol-5-yl)-2-(4-benzylpiperidin-1-yl)-7-oxo-6,7-dihydro-5H-pyrano[2,3-d]pyrimidine-5-carboxamide
Chemical Structure Depiction of
4-amino-N-(2H-1,3-benzodioxol-5-yl)-2-(4-benzylpiperidin-1-yl)-7-oxo-6,7-dihydro-5H-pyrano[2,3-d]pyrimidine-5-carboxamide
4-amino-N-(2H-1,3-benzodioxol-5-yl)-2-(4-benzylpiperidin-1-yl)-7-oxo-6,7-dihydro-5H-pyrano[2,3-d]pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | 8020-2905 |
| Compound Name: | 4-amino-N-(2H-1,3-benzodioxol-5-yl)-2-(4-benzylpiperidin-1-yl)-7-oxo-6,7-dihydro-5H-pyrano[2,3-d]pyrimidine-5-carboxamide |
| Molecular Weight: | 501.54 |
| Molecular Formula: | C27 H27 N5 O5 |
| Smiles: | C1CN(CCC1Cc1ccccc1)c1nc(c2C(CC(=O)Oc2n1)C(Nc1ccc2c(c1)OCO2)=O)N |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3297 |
| logD: | 4.2932 |
| logSw: | -4.584 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 103.147 |
| InChI Key: | TWNRSAWMUXMJQV-IBGZPJMESA-N |