6-ethyl-2-{[(3-fluorophenyl)methyl]sulfanyl}-3-methyl-5-[(3-methylphenyl)methyl]pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-ethyl-2-{[(3-fluorophenyl)methyl]sulfanyl}-3-methyl-5-[(3-methylphenyl)methyl]pyrimidin-4(3H)-one
6-ethyl-2-{[(3-fluorophenyl)methyl]sulfanyl}-3-methyl-5-[(3-methylphenyl)methyl]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V007-6560 |
| Compound Name: | 6-ethyl-2-{[(3-fluorophenyl)methyl]sulfanyl}-3-methyl-5-[(3-methylphenyl)methyl]pyrimidin-4(3H)-one |
| Molecular Weight: | 382.5 |
| Molecular Formula: | C22 H23 F N2 O S |
| Smiles: | CCC1=C(Cc2cccc(C)c2)C(N(C)C(=N1)SCc1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2084 |
| logD: | 5.2084 |
| logSw: | -5.0646 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 25.7951 |
| InChI Key: | XQHNVBDIZONMGL-UHFFFAOYSA-N |