butyl {4-hydroxy-6-methyl-2-[(prop-2-en-1-yl)sulfanyl]pyrimidin-5-yl}acetate
Chemical Structure Depiction of
butyl {4-hydroxy-6-methyl-2-[(prop-2-en-1-yl)sulfanyl]pyrimidin-5-yl}acetate
butyl {4-hydroxy-6-methyl-2-[(prop-2-en-1-yl)sulfanyl]pyrimidin-5-yl}acetate
Compound characteristics
| Compound ID: | 4386-4621 |
| Compound Name: | butyl {4-hydroxy-6-methyl-2-[(prop-2-en-1-yl)sulfanyl]pyrimidin-5-yl}acetate |
| Molecular Weight: | 296.39 |
| Molecular Formula: | C14 H20 N2 O3 S |
| Smiles: | CCCCOC(Cc1c(C)nc(nc1O)SCC=C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9663 |
| logD: | 2.8829 |
| logSw: | -2.8067 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.522 |
| InChI Key: | CYLQZYZMPQQEQL-UHFFFAOYSA-N |