1-benzyl-4-(benzylsulfanyl)-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
Chemical Structure Depiction of
1-benzyl-4-(benzylsulfanyl)-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
1-benzyl-4-(benzylsulfanyl)-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
Compound characteristics
| Compound ID: | D468-0648 |
| Compound Name: | 1-benzyl-4-(benzylsulfanyl)-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])(c1ccccc1)SC1C2CCCC=2N(Cc2ccccc2)C(N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1441 |
| logD: | 4.1441 |
| logSw: | -4.2248 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.4858 |
| InChI Key: | KZLLGANDYUFZGY-UHFFFAOYSA-N |