2-bromo-N-(5-{[(3-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Chemical Structure Depiction of
2-bromo-N-(5-{[(3-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
2-bromo-N-(5-{[(3-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Compound characteristics
| Compound ID: | V012-0480 |
| Compound Name: | 2-bromo-N-(5-{[(3-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide |
| Molecular Weight: | 424.31 |
| Molecular Formula: | C16 H11 Br F N3 O S2 |
| Salt: | not_available |
| Smiles: | C(c1cccc(c1)F)Sc1nnc(NC(c2ccccc2[Br])=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.921 |
| logD: | 4.6302 |
| logSw: | -4.8598 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.964 |
| InChI Key: | XVTNLBVGKNLNMZ-UHFFFAOYSA-N |