N-(3-{5-methyl-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazol-4-yl}-1,2,4-thiadiazol-5-yl)furan-2-carboxamide
Chemical Structure Depiction of
N-(3-{5-methyl-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazol-4-yl}-1,2,4-thiadiazol-5-yl)furan-2-carboxamide
N-(3-{5-methyl-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazol-4-yl}-1,2,4-thiadiazol-5-yl)furan-2-carboxamide
Compound characteristics
| Compound ID: | C200-5012 |
| Compound Name: | N-(3-{5-methyl-1-[3-(methylsulfanyl)phenyl]-1H-1,2,3-triazol-4-yl}-1,2,4-thiadiazol-5-yl)furan-2-carboxamide |
| Molecular Weight: | 398.46 |
| Molecular Formula: | C17 H14 N6 O2 S2 |
| Smiles: | Cc1c(c2nc(NC(c3ccco3)=O)sn2)nnn1c1cccc(c1)SC |
| Stereo: | ACHIRAL |
| logP: | 3.227 |
| logD: | 3.2255 |
| logSw: | -3.5515 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.339 |
| InChI Key: | QVRJCWSZSKGJOL-UHFFFAOYSA-N |