4-{[(4-chlorophenyl)methyl]sulfanyl}-1-ethyl-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
Chemical Structure Depiction of
4-{[(4-chlorophenyl)methyl]sulfanyl}-1-ethyl-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
4-{[(4-chlorophenyl)methyl]sulfanyl}-1-ethyl-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
Compound characteristics
| Compound ID: | D468-0506 |
| Compound Name: | 4-{[(4-chlorophenyl)methyl]sulfanyl}-1-ethyl-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one |
| Molecular Weight: | 320.84 |
| Molecular Formula: | C16 H17 Cl N2 O S |
| Smiles: | [H]C([H])(c1ccc(cc1)[Cl])SC1C2CCCC=2N(CC)C(N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4368 |
| logD: | 3.4368 |
| logSw: | -3.7609 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.4821 |
| InChI Key: | MXQXKMUHGBBHTI-UHFFFAOYSA-N |