N-(5-{[(2-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-4-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-(5-{[(2-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-4-(trifluoromethyl)benzamide
N-(5-{[(2-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-4-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V027-6076 |
| Compound Name: | N-(5-{[(2-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-4-(trifluoromethyl)benzamide |
| Molecular Weight: | 413.41 |
| Molecular Formula: | C17 H11 F4 N3 O S2 |
| Salt: | not_available |
| Smiles: | C(c1ccccc1F)Sc1nnc(NC(c2ccc(cc2)C(F)(F)F)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.6489 |
| logD: | 5.5928 |
| logSw: | -5.9585 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.964 |
| InChI Key: | IOHIFWDYQHCRJI-UHFFFAOYSA-N |