4-tert-butyl-N-(5-{[(8-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Chemical Structure Depiction of
4-tert-butyl-N-(5-{[(8-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
4-tert-butyl-N-(5-{[(8-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Compound characteristics
| Compound ID: | G755-0407 |
| Compound Name: | 4-tert-butyl-N-(5-{[(8-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide |
| Molecular Weight: | 465.6 |
| Molecular Formula: | C23 H23 N5 O2 S2 |
| Smiles: | CC1C=CN2C(C=1)=NC(CSc1nnc(NC(c3ccc(cc3)C(C)(C)C)=O)s1)=CC2=O |
| Stereo: | ACHIRAL |
| logP: | 5.0907 |
| logD: | 5.0345 |
| logSw: | -4.878 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.951 |
| InChI Key: | NAZRDNIRZSXCER-UHFFFAOYSA-N |