1-(4-chlorobenzene-1-sulfonyl)-3-(pyridin-3-yl)-N-[(thiophen-2-yl)methyl]-1H-1,2,4-triazol-5-amine
Chemical Structure Depiction of
1-(4-chlorobenzene-1-sulfonyl)-3-(pyridin-3-yl)-N-[(thiophen-2-yl)methyl]-1H-1,2,4-triazol-5-amine
1-(4-chlorobenzene-1-sulfonyl)-3-(pyridin-3-yl)-N-[(thiophen-2-yl)methyl]-1H-1,2,4-triazol-5-amine
Compound characteristics
| Compound ID: | D116-0205 |
| Compound Name: | 1-(4-chlorobenzene-1-sulfonyl)-3-(pyridin-3-yl)-N-[(thiophen-2-yl)methyl]-1H-1,2,4-triazol-5-amine |
| Molecular Weight: | 431.92 |
| Molecular Formula: | C18 H14 Cl N5 O2 S2 |
| Smiles: | C(c1cccs1)Nc1nc(c2cccnc2)nn1S(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4768 |
| logD: | 3.1451 |
| logSw: | -3.9865 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.77 |
| InChI Key: | NQYDSXVBDCTXGY-UHFFFAOYSA-N |