N-(5-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-phenoxyacetamide
Chemical Structure Depiction of
N-(5-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-phenoxyacetamide
N-(5-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-phenoxyacetamide
Compound characteristics
| Compound ID: | G755-0290 |
| Compound Name: | N-(5-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-phenoxyacetamide |
| Molecular Weight: | 439.51 |
| Molecular Formula: | C20 H17 N5 O3 S2 |
| Smiles: | CC1=CC=CN2C1=NC(CSc1nnc(NC(COc3ccccc3)=O)s1)=CC2=O |
| Stereo: | ACHIRAL |
| logP: | 3.2542 |
| logD: | 3.2525 |
| logSw: | -3.4326 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.257 |
| InChI Key: | NUWJWZJQPPNONL-UHFFFAOYSA-N |