2-(ethylsulfanyl)ethyl 4-(2H-1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
2-(ethylsulfanyl)ethyl 4-(2H-1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
2-(ethylsulfanyl)ethyl 4-(2H-1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 1630-0226 |
| Compound Name: | 2-(ethylsulfanyl)ethyl 4-(2H-1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 364.42 |
| Molecular Formula: | C17 H20 N2 O5 S |
| Smiles: | CCSCCOC(C1C(c2ccc3c(c2)OCO3)NC(NC=1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.127 |
| logD: | 1.9767 |
| logSw: | -2.9546 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.855 |
| InChI Key: | UKUBPMORRHMKSF-HNNXBMFYSA-N |