2-(ethylsulfanyl)ethyl 4-(2H-1,3-benzodioxol-5-yl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
2-(ethylsulfanyl)ethyl 4-(2H-1,3-benzodioxol-5-yl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
2-(ethylsulfanyl)ethyl 4-(2H-1,3-benzodioxol-5-yl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 1630-1734 |
| Compound Name: | 2-(ethylsulfanyl)ethyl 4-(2H-1,3-benzodioxol-5-yl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 378.45 |
| Molecular Formula: | C18 H22 N2 O5 S |
| Smiles: | CCSCCOC(C1C(c2ccc3c(c2)OCO3)NC(N(C)C=1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.577 |
| logD: | 2.5769 |
| logSw: | -3.0164 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.838 |
| InChI Key: | IIHRYXVXHUVJDZ-INIZCTEOSA-N |