7-[4-(cyclohexanecarbonyl)piperazin-1-yl]-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-[4-(cyclohexanecarbonyl)piperazin-1-yl]-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-[4-(cyclohexanecarbonyl)piperazin-1-yl]-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | F529-0092 |
| Compound Name: | 7-[4-(cyclohexanecarbonyl)piperazin-1-yl]-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 437.56 |
| Molecular Formula: | C23 H27 N5 O2 S |
| Smiles: | Cc1ccccc1C1=NN2C(=NC(=CC2=O)N2CCN(CC2)C(C2CCCCC2)=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.5697 |
| logD: | 3.5656 |
| logSw: | -3.6794 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.017 |
| InChI Key: | QDMOSWBQHPHMJR-UHFFFAOYSA-N |