7-{[4-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)piperazin-1-yl]methyl}-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-{[4-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)piperazin-1-yl]methyl}-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-{[4-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)piperazin-1-yl]methyl}-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | F570-0063 |
| Compound Name: | 7-{[4-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)piperazin-1-yl]methyl}-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 500.6 |
| Molecular Formula: | C22 H24 N6 O4 S2 |
| Smiles: | Cc1ccccc1C1=NN2C(=NC(CN3CCN(CC3)S(c3c(C)noc3C)(=O)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 1.5243 |
| logD: | 1.5227 |
| logSw: | -2.5627 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 95.56 |
| InChI Key: | SCPQPQMCWHCDIY-UHFFFAOYSA-N |