N-(3-chlorophenyl)-4-{[2-(2-methoxyphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}piperazine-1-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-4-{[2-(2-methoxyphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}piperazine-1-carboxamide
N-(3-chlorophenyl)-4-{[2-(2-methoxyphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}piperazine-1-carboxamide
Compound characteristics
| Compound ID: | G768-1467 |
| Compound Name: | N-(3-chlorophenyl)-4-{[2-(2-methoxyphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}piperazine-1-carboxamide |
| Molecular Weight: | 511 |
| Molecular Formula: | C24 H23 Cl N6 O3 S |
| Smiles: | COc1ccccc1C1=NN2C(=NC(CN3CCN(CC3)C(Nc3cccc(c3)[Cl])=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.168 |
| logD: | 3.0834 |
| logSw: | -3.6448 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.911 |
| InChI Key: | JNDMQDOGBSUEET-UHFFFAOYSA-N |