4-{[(3-methylphenyl)methyl]sulfanyl}-1-phenyl-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
Chemical Structure Depiction of
4-{[(3-methylphenyl)methyl]sulfanyl}-1-phenyl-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
4-{[(3-methylphenyl)methyl]sulfanyl}-1-phenyl-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
Compound characteristics
| Compound ID: | D468-0982 |
| Compound Name: | 4-{[(3-methylphenyl)methyl]sulfanyl}-1-phenyl-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one |
| Molecular Weight: | 348.47 |
| Molecular Formula: | C21 H20 N2 O S |
| Smiles: | [H]C([H])(c1cccc(C)c1)SC1C2CCCC=2N(C(N=1)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.471 |
| logD: | 4.4709 |
| logSw: | -4.4027 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 23.8743 |
| InChI Key: | VZTHCFFDQYOEMN-UHFFFAOYSA-N |