N-(3-chloro-2-methylphenyl)-4-[2-(2-methylphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]piperazine-1-carboxamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-4-[2-(2-methylphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]piperazine-1-carboxamide
N-(3-chloro-2-methylphenyl)-4-[2-(2-methylphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | F525-0058 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-4-[2-(2-methylphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]piperazine-1-carboxamide |
| Molecular Weight: | 495 |
| Molecular Formula: | C24 H23 Cl N6 O2 S |
| Smiles: | Cc1ccccc1C1=NN2C(=NC(=CC2=O)N2CCN(CC2)C(Nc2cccc(c2C)[Cl])=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.5091 |
| logD: | 4.505 |
| logSw: | -4.5493 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.948 |
| InChI Key: | KCPMXEJTSXQGDA-UHFFFAOYSA-N |