1-cyclohexyl-4-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
Chemical Structure Depiction of
1-cyclohexyl-4-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
1-cyclohexyl-4-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
Compound characteristics
| Compound ID: | D468-0684 |
| Compound Name: | 1-cyclohexyl-4-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one |
| Molecular Weight: | 382.52 |
| Molecular Formula: | C22 H26 N2 O2 S |
| Smiles: | [H]C([H])(C(c1ccc(C)cc1)=O)SC1C2CCCC=2N(C2CCCCC2)C(N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4069 |
| logD: | 4.4069 |
| logSw: | -4.241 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 36.954 |
| InChI Key: | LCTQJBUGIOULFN-UHFFFAOYSA-N |