1-(3-methoxyphenyl)-4-{[(4-methylphenyl)methyl]sulfanyl}-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
Chemical Structure Depiction of
1-(3-methoxyphenyl)-4-{[(4-methylphenyl)methyl]sulfanyl}-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
1-(3-methoxyphenyl)-4-{[(4-methylphenyl)methyl]sulfanyl}-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
Compound characteristics
| Compound ID: | D468-1258 |
| Compound Name: | 1-(3-methoxyphenyl)-4-{[(4-methylphenyl)methyl]sulfanyl}-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one |
| Molecular Weight: | 378.49 |
| Molecular Formula: | C22 H22 N2 O2 S |
| Smiles: | [H]C([H])(c1ccc(C)cc1)SC1C2CCCC=2N(C(N=1)=O)c1cccc(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.2557 |
| logD: | 4.2556 |
| logSw: | -4.3097 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 31.4181 |
| InChI Key: | XLUBHXBHTMKWEP-UHFFFAOYSA-N |