3,4-dimethyl-N-({5-sulfanylidene-4-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-1,2,4-triazol-3-yl}methyl)benzamide
Chemical Structure Depiction of
3,4-dimethyl-N-({5-sulfanylidene-4-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-1,2,4-triazol-3-yl}methyl)benzamide
3,4-dimethyl-N-({5-sulfanylidene-4-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-1,2,4-triazol-3-yl}methyl)benzamide
Compound characteristics
| Compound ID: | 2515-5744 |
| Compound Name: | 3,4-dimethyl-N-({5-sulfanylidene-4-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-1,2,4-triazol-3-yl}methyl)benzamide |
| Molecular Weight: | 406.43 |
| Molecular Formula: | C19 H17 F3 N4 O S |
| Smiles: | Cc1ccc(cc1C)C(NCC1=NNC(N1c1cccc(c1)C(F)(F)F)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4573 |
| logD: | 4.1227 |
| logSw: | -4.2947 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.514 |
| InChI Key: | CHLRSBFCLNSDMA-UHFFFAOYSA-N |