ethyl 6-methyl-4-{2-[(propan-2-yl)oxy]phenyl}-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 6-methyl-4-{2-[(propan-2-yl)oxy]phenyl}-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 6-methyl-4-{2-[(propan-2-yl)oxy]phenyl}-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 4590-0136 |
| Compound Name: | ethyl 6-methyl-4-{2-[(propan-2-yl)oxy]phenyl}-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 334.44 |
| Molecular Formula: | C17 H22 N2 O3 S |
| Smiles: | CCOC(C1C(c2ccccc2OC(C)C)NC(NC=1C)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1022 |
| logD: | 3.0862 |
| logSw: | -3.3291 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.317 |
| InChI Key: | DLKQUSGUFCLFAU-OAHLLOKOSA-N |