N-{[5-amino-1-(4-methoxybenzene-1-sulfonyl)-1H-1,2,4-triazol-3-yl]methyl}-4-methoxybenzene-1-sulfonamide
Chemical Structure Depiction of
N-{[5-amino-1-(4-methoxybenzene-1-sulfonyl)-1H-1,2,4-triazol-3-yl]methyl}-4-methoxybenzene-1-sulfonamide
N-{[5-amino-1-(4-methoxybenzene-1-sulfonyl)-1H-1,2,4-triazol-3-yl]methyl}-4-methoxybenzene-1-sulfonamide
Compound characteristics
| Compound ID: | C908-0190 |
| Compound Name: | N-{[5-amino-1-(4-methoxybenzene-1-sulfonyl)-1H-1,2,4-triazol-3-yl]methyl}-4-methoxybenzene-1-sulfonamide |
| Molecular Weight: | 453.49 |
| Molecular Formula: | C17 H19 N5 O6 S2 |
| Smiles: | COc1ccc(cc1)S(NCc1nc(N)n(n1)S(c1ccc(cc1)OC)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4397 |
| logD: | 1.4289 |
| logSw: | -2.5227 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 128.961 |
| InChI Key: | KABLBBKTZCCXFT-UHFFFAOYSA-N |