2-({2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-5-(4-methoxybenzene-1-sulfonyl)pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-({2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-5-(4-methoxybenzene-1-sulfonyl)pyrimidin-4(3H)-one
2-({2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-5-(4-methoxybenzene-1-sulfonyl)pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | G605-0868 |
| Compound Name: | 2-({2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-5-(4-methoxybenzene-1-sulfonyl)pyrimidin-4(3H)-one |
| Molecular Weight: | 518.58 |
| Molecular Formula: | C23 H23 F N4 O5 S2 |
| Smiles: | COc1ccc(cc1)S(C1=CN=C(NC1=O)SCC(N1CCN(CC1)c1ccc(cc1)F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0496 |
| logD: | 0.4079 |
| logSw: | -2.7843 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.187 |
| InChI Key: | URNDVLQMILGEAK-UHFFFAOYSA-N |