2-(4-chlorophenyl)-7-{[4-(3,5-dimethyl-1,2-oxazole-4-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-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-(4-chlorophenyl)-7-{[4-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | F570-0257 |
| Compound Name: | 2-(4-chlorophenyl)-7-{[4-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 521.02 |
| Molecular Formula: | C21 H21 Cl N6 O4 S2 |
| Smiles: | Cc1c(c(C)on1)S(N1CCN(CC1)CC1=CC(N2C(=N1)SC(c1ccc(cc1)[Cl])=N2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8857 |
| logD: | 1.884 |
| logSw: | -2.8816 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 95.56 |
| InChI Key: | MGTKMHYIETYACE-UHFFFAOYSA-N |