ethyl 4-(2H-1,3-benzodioxol-5-yl)-6-[(4-methylpiperazin-1-yl)methyl]-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(2H-1,3-benzodioxol-5-yl)-6-[(4-methylpiperazin-1-yl)methyl]-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(2H-1,3-benzodioxol-5-yl)-6-[(4-methylpiperazin-1-yl)methyl]-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 8020-4972 |
| Compound Name: | ethyl 4-(2H-1,3-benzodioxol-5-yl)-6-[(4-methylpiperazin-1-yl)methyl]-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 402.45 |
| Molecular Formula: | C20 H26 N4 O5 |
| Smiles: | CCOC(C1C(c2ccc3c(c2)OCO3)NC(NC=1CN1CCN(C)CC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.0055 |
| logD: | 1.0055 |
| logSw: | -2.2401 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.377 |
| InChI Key: | IPTNLUUKHJOWEC-GOSISDBHSA-N |