2-(3,4-dimethylphenoxy)-N-(5-{[(2-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
Chemical Structure Depiction of
2-(3,4-dimethylphenoxy)-N-(5-{[(2-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
2-(3,4-dimethylphenoxy)-N-(5-{[(2-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | G072-2305 |
| Compound Name: | 2-(3,4-dimethylphenoxy)-N-(5-{[(2-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide |
| Molecular Weight: | 473.59 |
| Molecular Formula: | C20 H19 N5 O3 S3 |
| Smiles: | CC1=CN2C(=NC(CSc3nnc(NC(COc4ccc(C)c(C)c4)=O)s3)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.1222 |
| logD: | 4.1206 |
| logSw: | -4.2781 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.724 |
| InChI Key: | PTTQFXGEBYBWCW-UHFFFAOYSA-N |