6-methyl-2-[(2-{4-[(propan-2-yl)oxy]phenoxy}ethyl)sulfanyl]pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-methyl-2-[(2-{4-[(propan-2-yl)oxy]phenoxy}ethyl)sulfanyl]pyrimidin-4(3H)-one
6-methyl-2-[(2-{4-[(propan-2-yl)oxy]phenoxy}ethyl)sulfanyl]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 4657-0429 |
| Compound Name: | 6-methyl-2-[(2-{4-[(propan-2-yl)oxy]phenoxy}ethyl)sulfanyl]pyrimidin-4(3H)-one |
| Molecular Weight: | 320.41 |
| Molecular Formula: | C16 H20 N2 O3 S |
| Smiles: | CC(C)Oc1ccc(cc1)OCCSC1NC(C=C(C)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7695 |
| logD: | 2.035 |
| logSw: | -3.2249 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.52 |
| InChI Key: | LGXZHFDEVHNYNR-UHFFFAOYSA-N |