N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{3-[(4-chlorophenyl)methyl]-2,4-dioxo-3,4-dihydropyrido[3,2-d]pyrimidin-1(2H)-yl}acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{3-[(4-chlorophenyl)methyl]-2,4-dioxo-3,4-dihydropyrido[3,2-d]pyrimidin-1(2H)-yl}acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{3-[(4-chlorophenyl)methyl]-2,4-dioxo-3,4-dihydropyrido[3,2-d]pyrimidin-1(2H)-yl}acetamide
Compound characteristics
| Compound ID: | F521-0416 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{3-[(4-chlorophenyl)methyl]-2,4-dioxo-3,4-dihydropyrido[3,2-d]pyrimidin-1(2H)-yl}acetamide |
| Molecular Weight: | 478.89 |
| Molecular Formula: | C24 H19 Cl N4 O5 |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(CN1C(N(Cc2ccc(cc2)[Cl])C(c2c1cccn2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0873 |
| logD: | 3.0873 |
| logSw: | -3.4473 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.763 |
| InChI Key: | JISPPTIPJXLBKQ-UHFFFAOYSA-N |