2-{[(4-fluorophenyl)methyl]sulfanyl}-3,6-dimethyl-5-[(2-methylphenyl)methyl]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(4-fluorophenyl)methyl]sulfanyl}-3,6-dimethyl-5-[(2-methylphenyl)methyl]pyrimidin-4(3H)-one
2-{[(4-fluorophenyl)methyl]sulfanyl}-3,6-dimethyl-5-[(2-methylphenyl)methyl]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V027-0008 |
| Compound Name: | 2-{[(4-fluorophenyl)methyl]sulfanyl}-3,6-dimethyl-5-[(2-methylphenyl)methyl]pyrimidin-4(3H)-one |
| Molecular Weight: | 368.47 |
| Molecular Formula: | C21 H21 F N2 O S |
| Salt: | not_available |
| Smiles: | CC1=C(Cc2ccccc2C)C(N(C)C(=N1)SCc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4478 |
| logD: | 4.4478 |
| logSw: | -4.3994 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 25.1882 |
| InChI Key: | VCUAPPFKCKKXJK-UHFFFAOYSA-N |