ethyl 6-({[(2H-1,3-benzodioxol-5-yl)methyl](pyridine-3-carbonyl)amino}methyl)-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 6-({[(2H-1,3-benzodioxol-5-yl)methyl](pyridine-3-carbonyl)amino}methyl)-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 6-({[(2H-1,3-benzodioxol-5-yl)methyl](pyridine-3-carbonyl)amino}methyl)-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 8018-0946 |
| Compound Name: | ethyl 6-({[(2H-1,3-benzodioxol-5-yl)methyl](pyridine-3-carbonyl)amino}methyl)-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 544.56 |
| Molecular Formula: | C29 H28 N4 O7 |
| Smiles: | CCOC(C1C(c2ccc(cc2)OC)NC(NC=1CN(Cc1ccc2c(c1)OCO2)C(c1cccnc1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2605 |
| logD: | 2.0448 |
| logSw: | -2.6229 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 107.169 |
| InChI Key: | LPOPDQMNJZBVDP-AREMUKBSSA-N |