N-(5-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-(phenylsulfanyl)acetamide
Chemical Structure Depiction of
N-(5-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-(phenylsulfanyl)acetamide
N-(5-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-(phenylsulfanyl)acetamide
Compound characteristics
| Compound ID: | G755-0197 |
| Compound Name: | N-(5-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-(phenylsulfanyl)acetamide |
| Molecular Weight: | 441.55 |
| Molecular Formula: | C19 H15 N5 O2 S3 |
| Smiles: | C(C1=CC(N2C=CC=CC2=N1)=O)Sc1nnc(NC(CSc2ccccc2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.1854 |
| logD: | 3.1838 |
| logSw: | -3.3907 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.737 |
| InChI Key: | PLSLSSUEBDMPFY-UHFFFAOYSA-N |