2-fluoro-N-(5-{[(3-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Chemical Structure Depiction of
2-fluoro-N-(5-{[(3-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
2-fluoro-N-(5-{[(3-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Compound characteristics
| Compound ID: | G072-2212 |
| Compound Name: | 2-fluoro-N-(5-{[(3-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide |
| Molecular Weight: | 433.5 |
| Molecular Formula: | C17 H12 F N5 O2 S3 |
| Smiles: | CC1=CSC2=NC(CSc3nnc(NC(c4ccccc4F)=O)s3)=CC(N12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2238 |
| logD: | 2.933 |
| logSw: | -3.7554 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.584 |
| InChI Key: | XVVYKAUVLOBYLI-UHFFFAOYSA-N |