7-{[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]methyl}-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-{[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]methyl}-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-{[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]methyl}-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G768-0117 |
| Compound Name: | 7-{[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]methyl}-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 505.6 |
| Molecular Formula: | C26 H27 N5 O4 S |
| Smiles: | Cc1ccccc1C1=NN2C(=NC(CN3CCN(CC3)C(c3ccc(c(c3)OC)OC)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 2.084 |
| logD: | 2.0803 |
| logSw: | -2.8847 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.72 |
| InChI Key: | GZCXSBHZCOUDSI-UHFFFAOYSA-N |