2-(4-chlorophenyl)-7-{[4-(4-methoxybenzene-1-sulfonyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-(4-chlorophenyl)-7-{[4-(4-methoxybenzene-1-sulfonyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-(4-chlorophenyl)-7-{[4-(4-methoxybenzene-1-sulfonyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | F570-0275 |
| Compound Name: | 2-(4-chlorophenyl)-7-{[4-(4-methoxybenzene-1-sulfonyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 532.04 |
| Molecular Formula: | C23 H22 Cl N5 O4 S2 |
| Smiles: | COc1ccc(cc1)S(N1CCN(CC1)CC1=CC(N2C(=N1)SC(c1ccc(cc1)[Cl])=N2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.159 |
| logD: | 3.1574 |
| logSw: | -3.6906 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 81.066 |
| InChI Key: | YITUATAGEMFWNL-UHFFFAOYSA-N |