4-(butylsulfanyl)-1-(4-methoxyphenyl)-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
Chemical Structure Depiction of
4-(butylsulfanyl)-1-(4-methoxyphenyl)-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
4-(butylsulfanyl)-1-(4-methoxyphenyl)-1,5,6,7-tetrahydro-2H-cyclopenta[d]pyrimidin-2-one
Compound characteristics
| Compound ID: | D468-1050 |
| Compound Name: | 4-(butylsulfanyl)-1-(4-methoxyphenyl)-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])(CCC)SC1C2CCCC=2N(C(N=1)=O)c1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 3.8339 |
| logD: | 3.8339 |
| logSw: | -3.8222 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 31.69 |
| InChI Key: | FQJMHYFOEDBAGS-UHFFFAOYSA-N |