4-{[2-(4-methoxyphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}-N-phenylpiperazine-1-carboxamide
Chemical Structure Depiction of
4-{[2-(4-methoxyphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}-N-phenylpiperazine-1-carboxamide
4-{[2-(4-methoxyphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}-N-phenylpiperazine-1-carboxamide
Compound characteristics
Compound ID: | G768-1607 |
Compound Name: | 4-{[2-(4-methoxyphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}-N-phenylpiperazine-1-carboxamide |
Molecular Weight: | 476.56 |
Molecular Formula: | C24 H24 N6 O3 S |
Smiles: | COc1ccc(cc1)C1=NN2C(=NC(CN3CCN(CC3)C(Nc3ccccc3)=O)=CC2=O)S1 |
Stereo: | ACHIRAL |
logP: | 2.4615 |
logD: | 2.3769 |
logSw: | -2.8572 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 74.824 |
InChI Key: | MHRQDIDGUVZZOL-UHFFFAOYSA-N |