5-{[(4-bromo-2-fluorophenyl)carbamamido]methyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-{[(4-bromo-2-fluorophenyl)carbamamido]methyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-{[(4-bromo-2-fluorophenyl)carbamamido]methyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L062-0506 |
| Compound Name: | 5-{[(4-bromo-2-fluorophenyl)carbamamido]methyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 450.29 |
| Molecular Formula: | C17 H13 Br F N5 O2 S |
| Smiles: | C(c1nnc(C(Nc2ccccc2)=O)s1)NC(Nc1ccc(cc1F)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.3459 |
| logD: | 3.3452 |
| logSw: | -3.6692 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.256 |
| InChI Key: | WKCOOPXCLPZIFS-UHFFFAOYSA-N |