N-({5-({2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}methyl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-({5-({2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}methyl)thiophene-2-carboxamide
N-({5-({2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}methyl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | K400-10315 |
| Compound Name: | N-({5-({2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}methyl)thiophene-2-carboxamide |
| Molecular Weight: | 539.58 |
| Molecular Formula: | C20 H16 F3 N7 O2 S3 |
| Smiles: | Cc1nnc(NC(CSc2nnc(CNC(c3cccs3)=O)n2c2cccc(c2)C(F)(F)F)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.0818 |
| logD: | 3.041 |
| logSw: | -3.3924 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.893 |
| InChI Key: | AFDKUZOOSCVTEX-UHFFFAOYSA-N |