2-(4-methoxyphenyl)-7-({4-[(phenylsulfanyl)acetyl]piperazin-1-yl}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-(4-methoxyphenyl)-7-({4-[(phenylsulfanyl)acetyl]piperazin-1-yl}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-(4-methoxyphenyl)-7-({4-[(phenylsulfanyl)acetyl]piperazin-1-yl}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | G768-0959 |
| Compound Name: | 2-(4-methoxyphenyl)-7-({4-[(phenylsulfanyl)acetyl]piperazin-1-yl}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 507.63 |
| Molecular Formula: | C25 H25 N5 O3 S2 |
| Smiles: | COc1ccc(cc1)C1=NN2C(=NC(CN3CCN(CC3)C(CSc3ccccc3)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 2.7759 |
| logD: | 2.7736 |
| logSw: | -3.0923 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 65.476 |
| InChI Key: | LCRWNDATOXPIKN-UHFFFAOYSA-N |