1-(4-chlorobenzene-1-sulfonyl)-N-{[4-(dimethylamino)phenyl]methyl}-3-(furan-2-yl)-1H-1,2,4-triazol-5-amine
Chemical Structure Depiction of
1-(4-chlorobenzene-1-sulfonyl)-N-{[4-(dimethylamino)phenyl]methyl}-3-(furan-2-yl)-1H-1,2,4-triazol-5-amine
1-(4-chlorobenzene-1-sulfonyl)-N-{[4-(dimethylamino)phenyl]methyl}-3-(furan-2-yl)-1H-1,2,4-triazol-5-amine
Compound characteristics
| Compound ID: | D331-0281 |
| Compound Name: | 1-(4-chlorobenzene-1-sulfonyl)-N-{[4-(dimethylamino)phenyl]methyl}-3-(furan-2-yl)-1H-1,2,4-triazol-5-amine |
| Molecular Weight: | 457.94 |
| Molecular Formula: | C21 H20 Cl N5 O3 S |
| Smiles: | CN(C)c1ccc(CNc2nc(c3ccco3)nn2S(c2ccc(cc2)[Cl])(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.0218 |
| logD: | 4.0064 |
| logSw: | -4.4413 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.617 |
| InChI Key: | WNWIBNLNHXXNIB-UHFFFAOYSA-N |