4-(benzylsulfanyl)-1-(3-methoxypropyl)-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
Chemical Structure Depiction of
4-(benzylsulfanyl)-1-(3-methoxypropyl)-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
4-(benzylsulfanyl)-1-(3-methoxypropyl)-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
Compound characteristics
| Compound ID: | D468-0847 |
| Compound Name: | 4-(benzylsulfanyl)-1-(3-methoxypropyl)-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one |
| Molecular Weight: | 330.45 |
| Molecular Formula: | C18 H22 N2 O2 S |
| Smiles: | [H]C([H])(c1ccccc1)SC1C2CCCC=2N(CCCOC)C(N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7363 |
| logD: | 2.7363 |
| logSw: | -2.858 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.078 |
| InChI Key: | MXSNLIQQZONREW-UHFFFAOYSA-N |