5-ethyl-6-hydroxy-3-(4-methylphenyl)-2-[(prop-2-en-1-yl)sulfanyl]pyrimidin-4(3H)-one
Chemical Structure Depiction of
5-ethyl-6-hydroxy-3-(4-methylphenyl)-2-[(prop-2-en-1-yl)sulfanyl]pyrimidin-4(3H)-one
5-ethyl-6-hydroxy-3-(4-methylphenyl)-2-[(prop-2-en-1-yl)sulfanyl]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | Y010-0732 |
| Compound Name: | 5-ethyl-6-hydroxy-3-(4-methylphenyl)-2-[(prop-2-en-1-yl)sulfanyl]pyrimidin-4(3H)-one |
| Molecular Weight: | 302.39 |
| Molecular Formula: | C16 H18 N2 O2 S |
| Smiles: | CCC1=C(N=C(N(C1=O)c1ccc(C)cc1)SCC=C)O |
| Stereo: | ACHIRAL |
| logP: | 3.2383 |
| logD: | -0.1569 |
| logSw: | -3.0475 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.602 |
| InChI Key: | QPSXDVURQQULPU-UHFFFAOYSA-N |