2-[(3-phenylpropyl)sulfanyl]-3,5,6,7-tetrahydro-4H-cyclopenta[d]pyrimidin-4-one
Chemical Structure Depiction of
2-[(3-phenylpropyl)sulfanyl]-3,5,6,7-tetrahydro-4H-cyclopenta[d]pyrimidin-4-one
2-[(3-phenylpropyl)sulfanyl]-3,5,6,7-tetrahydro-4H-cyclopenta[d]pyrimidin-4-one
Compound characteristics
| Compound ID: | D365-0281 |
| Compound Name: | 2-[(3-phenylpropyl)sulfanyl]-3,5,6,7-tetrahydro-4H-cyclopenta[d]pyrimidin-4-one |
| Molecular Weight: | 286.39 |
| Molecular Formula: | C16 H18 N2 O S |
| Smiles: | C1CC2=C(C1)N=C(NC2=O)SCCCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4581 |
| logD: | 3.2368 |
| logSw: | -3.7741 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.838 |
| InChI Key: | CBTFKNWTIFEQIG-UHFFFAOYSA-N |