6-methyl-2-{[(naphthalen-1-yl)methyl]sulfanyl}pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-methyl-2-{[(naphthalen-1-yl)methyl]sulfanyl}pyrimidin-4(3H)-one
6-methyl-2-{[(naphthalen-1-yl)methyl]sulfanyl}pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 4298-0797 |
| Compound Name: | 6-methyl-2-{[(naphthalen-1-yl)methyl]sulfanyl}pyrimidin-4(3H)-one |
| Molecular Weight: | 282.36 |
| Molecular Formula: | C16 H14 N2 O S |
| Smiles: | CC1=CC(NC(=N1)SCc1cccc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2359 |
| logD: | 2.7141 |
| logSw: | -3.415 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.028 |
| InChI Key: | BTRPBSQRBUFFHP-UHFFFAOYSA-N |