N-(5-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)pentanamide
Chemical Structure Depiction of
N-(5-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)pentanamide
N-(5-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)pentanamide
Compound characteristics
| Compound ID: | G755-0178 |
| Compound Name: | N-(5-{[(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)pentanamide |
| Molecular Weight: | 375.47 |
| Molecular Formula: | C16 H17 N5 O2 S2 |
| Smiles: | CCCCC(Nc1nnc(SCC2=CC(N3C=CC=CC3=N2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5728 |
| logD: | 2.5705 |
| logSw: | -2.7282 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.009 |
| InChI Key: | HMCCDULNAPXDRD-UHFFFAOYSA-N |