2-[(4-phenoxybutyl)sulfanyl]-3,5,6,7-tetrahydro-4H-cyclopenta[d]pyrimidin-4-one
Chemical Structure Depiction of
2-[(4-phenoxybutyl)sulfanyl]-3,5,6,7-tetrahydro-4H-cyclopenta[d]pyrimidin-4-one
2-[(4-phenoxybutyl)sulfanyl]-3,5,6,7-tetrahydro-4H-cyclopenta[d]pyrimidin-4-one
Compound characteristics
| Compound ID: | D467-0030 |
| Compound Name: | 2-[(4-phenoxybutyl)sulfanyl]-3,5,6,7-tetrahydro-4H-cyclopenta[d]pyrimidin-4-one |
| Molecular Weight: | 316.42 |
| Molecular Formula: | C17 H20 N2 O2 S |
| Smiles: | C1CC2=C(C1)N=C(NC2=O)SCCCCOc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3601 |
| logD: | 3.1388 |
| logSw: | -3.5772 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.256 |
| InChI Key: | ZSANBRCRDZWZET-UHFFFAOYSA-N |