7-{[4-(4-chlorobenzoyl)piperazin-1-yl]methyl}-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-{[4-(4-chlorobenzoyl)piperazin-1-yl]methyl}-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-{[4-(4-chlorobenzoyl)piperazin-1-yl]methyl}-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
Compound ID: | G768-0075 |
Compound Name: | 7-{[4-(4-chlorobenzoyl)piperazin-1-yl]methyl}-2-(2-methylphenyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
Molecular Weight: | 479.99 |
Molecular Formula: | C24 H22 Cl N5 O2 S |
Smiles: | Cc1ccccc1C1=NN2C(=NC(CN3CCN(CC3)C(c3ccc(cc3)[Cl])=O)=CC2=O)S1 |
Stereo: | ACHIRAL |
logP: | 3.1386 |
logD: | 3.1349 |
logSw: | -3.8138 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 58.459 |
InChI Key: | MMALXMGEZPULCL-UHFFFAOYSA-N |