7-[4-(3-chloro-4-fluorobenzoyl)piperazin-1-yl]-2-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-[4-(3-chloro-4-fluorobenzoyl)piperazin-1-yl]-2-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-[4-(3-chloro-4-fluorobenzoyl)piperazin-1-yl]-2-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | F529-0212 |
| Compound Name: | 7-[4-(3-chloro-4-fluorobenzoyl)piperazin-1-yl]-2-(3-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 483.95 |
| Molecular Formula: | C23 H19 Cl F N5 O2 S |
| Smiles: | Cc1cccc(c1)C1=NN2C(=NC(=CC2=O)N2CCN(CC2)C(c2ccc(c(c2)[Cl])F)=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.5131 |
| logD: | 3.5043 |
| logSw: | -3.9706 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.825 |
| InChI Key: | AAXRJLTZVUTHFP-UHFFFAOYSA-N |