1-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-2-(4-chlorophenyl)-6-oxo-1,6-dihydropyrimidine-5-carboxamide
Chemical Structure Depiction of
1-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-2-(4-chlorophenyl)-6-oxo-1,6-dihydropyrimidine-5-carboxamide
1-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-2-(4-chlorophenyl)-6-oxo-1,6-dihydropyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | P491-4042 |
| Compound Name: | 1-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxoethyl}-2-(4-chlorophenyl)-6-oxo-1,6-dihydropyrimidine-5-carboxamide |
| Molecular Weight: | 426.81 |
| Molecular Formula: | C20 H15 Cl N4 O5 |
| Smiles: | C(C(Nc1ccc2c(c1)OCO2)=O)N1C(c2ccc(cc2)[Cl])=NC=C(C(N)=O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 1.9247 |
| logD: | 1.9238 |
| logSw: | -3.105 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 99.662 |
| InChI Key: | NOZGNDPHSRLHHO-UHFFFAOYSA-N |