3-bromo-N-(5-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Chemical Structure Depiction of
3-bromo-N-(5-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
3-bromo-N-(5-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Compound characteristics
| Compound ID: | G755-0276 |
| Compound Name: | 3-bromo-N-(5-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide |
| Molecular Weight: | 488.38 |
| Molecular Formula: | C19 H14 Br N5 O2 S2 |
| Smiles: | CC1=CC=CN2C1=NC(CSc1nnc(NC(c3cccc(c3)[Br])=O)s1)=CC2=O |
| Stereo: | ACHIRAL |
| logP: | 4.197 |
| logD: | 3.9257 |
| logSw: | -4.3802 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.971 |
| InChI Key: | GZGUUDSXIIFKSF-UHFFFAOYSA-N |