7-{[4-(benzenesulfonyl)piperazin-1-yl]methyl}-2-(3-methoxyphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-{[4-(benzenesulfonyl)piperazin-1-yl]methyl}-2-(3-methoxyphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-{[4-(benzenesulfonyl)piperazin-1-yl]methyl}-2-(3-methoxyphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G768-0917 |
| Compound Name: | 7-{[4-(benzenesulfonyl)piperazin-1-yl]methyl}-2-(3-methoxyphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 497.59 |
| Molecular Formula: | C23 H23 N5 O4 S2 |
| Smiles: | COc1cccc(c1)C1=NN2C(=NC(CN3CCN(CC3)S(c3ccccc3)(=O)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 2.4333 |
| logD: | 2.4294 |
| logSw: | -2.851 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 81.066 |
| InChI Key: | DPLISXDITDJIBN-UHFFFAOYSA-N |