1-(3-acetylphenyl)-4-{[(2-chlorophenyl)methyl]sulfanyl}-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
Chemical Structure Depiction of
1-(3-acetylphenyl)-4-{[(2-chlorophenyl)methyl]sulfanyl}-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
1-(3-acetylphenyl)-4-{[(2-chlorophenyl)methyl]sulfanyl}-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
Compound characteristics
| Compound ID: | D468-1188 |
| Compound Name: | 1-(3-acetylphenyl)-4-{[(2-chlorophenyl)methyl]sulfanyl}-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one |
| Molecular Weight: | 410.92 |
| Molecular Formula: | C22 H19 Cl N2 O2 S |
| Smiles: | [H]C([H])(c1ccccc1[Cl])SC1C2CCCC=2N(C(N=1)=O)c1cccc(c1)C(C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.159 |
| logD: | 4.159 |
| logSw: | -4.4327 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 37.701 |
| InChI Key: | OFJKBRVYPJCNGM-UHFFFAOYSA-N |