N-{[5-amino-1-(4-chlorobenzene-1-sulfonyl)-1H-1,2,4-triazol-3-yl]methyl}-4-chlorobenzene-1-sulfonamide
Chemical Structure Depiction of
N-{[5-amino-1-(4-chlorobenzene-1-sulfonyl)-1H-1,2,4-triazol-3-yl]methyl}-4-chlorobenzene-1-sulfonamide
N-{[5-amino-1-(4-chlorobenzene-1-sulfonyl)-1H-1,2,4-triazol-3-yl]methyl}-4-chlorobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | C908-0170 |
| Compound Name: | N-{[5-amino-1-(4-chlorobenzene-1-sulfonyl)-1H-1,2,4-triazol-3-yl]methyl}-4-chlorobenzene-1-sulfonamide |
| Molecular Weight: | 462.33 |
| Molecular Formula: | C15 H13 Cl2 N5 O4 S2 |
| Smiles: | C(c1nc(N)n(n1)S(c1ccc(cc1)[Cl])(=O)=O)NS(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6644 |
| logD: | 2.6361 |
| logSw: | -3.4786 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 113.874 |
| InChI Key: | LJYQHESYHJPUPU-UHFFFAOYSA-N |