3-bromo-N-(5-{[(2,4-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Chemical Structure Depiction of
3-bromo-N-(5-{[(2,4-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
3-bromo-N-(5-{[(2,4-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Compound characteristics
| Compound ID: | V030-5100 |
| Compound Name: | 3-bromo-N-(5-{[(2,4-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide |
| Molecular Weight: | 442.3 |
| Molecular Formula: | C16 H10 Br F2 N3 O S2 |
| Salt: | not_available |
| Smiles: | C(c1ccc(cc1F)F)Sc1nnc(NC(c2cccc(c2)[Br])=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.6646 |
| logD: | 5.3933 |
| logSw: | -5.8847 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.964 |
| InChI Key: | YQWQFFSUSZHMGQ-UHFFFAOYSA-N |