3-(furan-2-yl)-N-[(2-methoxyphenyl)methyl]-1-(4-methylbenzene-1-sulfonyl)-1H-1,2,4-triazol-5-amine
Chemical Structure Depiction of
3-(furan-2-yl)-N-[(2-methoxyphenyl)methyl]-1-(4-methylbenzene-1-sulfonyl)-1H-1,2,4-triazol-5-amine
3-(furan-2-yl)-N-[(2-methoxyphenyl)methyl]-1-(4-methylbenzene-1-sulfonyl)-1H-1,2,4-triazol-5-amine
Compound characteristics
| Compound ID: | D331-0337 |
| Compound Name: | 3-(furan-2-yl)-N-[(2-methoxyphenyl)methyl]-1-(4-methylbenzene-1-sulfonyl)-1H-1,2,4-triazol-5-amine |
| Molecular Weight: | 424.48 |
| Molecular Formula: | C21 H20 N4 O4 S |
| Smiles: | Cc1ccc(cc1)S(n1c(NCc2ccccc2OC)nc(c2ccco2)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9818 |
| logD: | 3.9818 |
| logSw: | -4.0641 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.442 |
| InChI Key: | PEFUVSDAOAUQAJ-UHFFFAOYSA-N |