N-(4-methoxyphenyl)-5-({[3-(trifluoromethyl)phenyl]carbamamido}methyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-methoxyphenyl)-5-({[3-(trifluoromethyl)phenyl]carbamamido}methyl)-1,3,4-thiadiazole-2-carboxamide
N-(4-methoxyphenyl)-5-({[3-(trifluoromethyl)phenyl]carbamamido}methyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L062-0435 |
| Compound Name: | N-(4-methoxyphenyl)-5-({[3-(trifluoromethyl)phenyl]carbamamido}methyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 451.43 |
| Molecular Formula: | C19 H16 F3 N5 O3 S |
| Smiles: | COc1ccc(cc1)NC(c1nnc(CNC(Nc2cccc(c2)C(F)(F)F)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8818 |
| logD: | 3.8817 |
| logSw: | -4.2242 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 88.498 |
| InChI Key: | VLSJLFOBRVUCGI-UHFFFAOYSA-N |