6-methyl-2-({[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-methyl-2-({[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)pyrimidin-4(3H)-one
6-methyl-2-({[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | C200-5419 |
| Compound Name: | 6-methyl-2-({[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)pyrimidin-4(3H)-one |
| Molecular Weight: | 314.36 |
| Molecular Formula: | C15 H14 N4 O2 S |
| Smiles: | CC1=CC(NC(=N1)SCc1nc(c2cccc(C)c2)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9218 |
| logD: | 2.231 |
| logSw: | -3.2316 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.643 |
| InChI Key: | BSPVTTGPEVMGGM-UHFFFAOYSA-N |