5-[(4-fluorophenyl)methyl]-3,6-dimethyl-2-{[(3-methylphenyl)methyl]sulfanyl}pyrimidin-4(3H)-one
Chemical Structure Depiction of
5-[(4-fluorophenyl)methyl]-3,6-dimethyl-2-{[(3-methylphenyl)methyl]sulfanyl}pyrimidin-4(3H)-one
5-[(4-fluorophenyl)methyl]-3,6-dimethyl-2-{[(3-methylphenyl)methyl]sulfanyl}pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V009-9171 |
| Compound Name: | 5-[(4-fluorophenyl)methyl]-3,6-dimethyl-2-{[(3-methylphenyl)methyl]sulfanyl}pyrimidin-4(3H)-one |
| Molecular Weight: | 368.47 |
| Molecular Formula: | C21 H21 F N2 O S |
| Smiles: | CC1=C(Cc2ccc(cc2)F)C(N(C)C(=N1)SCc1cccc(C)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5724 |
| logD: | 4.5724 |
| logSw: | -4.5574 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 25.1882 |
| InChI Key: | VNRCNPASOKXMCE-UHFFFAOYSA-N |