N-{[4-(dimethylamino)phenyl]methyl}-3-(furan-2-yl)-1-(4-methoxybenzene-1-sulfonyl)-1H-1,2,4-triazol-5-amine
Chemical Structure Depiction of
N-{[4-(dimethylamino)phenyl]methyl}-3-(furan-2-yl)-1-(4-methoxybenzene-1-sulfonyl)-1H-1,2,4-triazol-5-amine
N-{[4-(dimethylamino)phenyl]methyl}-3-(furan-2-yl)-1-(4-methoxybenzene-1-sulfonyl)-1H-1,2,4-triazol-5-amine
Compound characteristics
| Compound ID: | D331-0284 |
| Compound Name: | N-{[4-(dimethylamino)phenyl]methyl}-3-(furan-2-yl)-1-(4-methoxybenzene-1-sulfonyl)-1H-1,2,4-triazol-5-amine |
| Molecular Weight: | 453.52 |
| Molecular Formula: | C22 H23 N5 O4 S |
| Smiles: | CN(C)c1ccc(CNc2nc(c3ccco3)nn2S(c2ccc(cc2)OC)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4095 |
| logD: | 3.3941 |
| logSw: | -3.9058 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.16 |
| InChI Key: | YOWIFFNLUAWVGF-UHFFFAOYSA-N |