N-{[4-(dimethylamino)phenyl]methyl}-1-(4-fluorobenzene-1-sulfonyl)-3-(furan-2-yl)-1H-1,2,4-triazol-5-amine
Chemical Structure Depiction of
N-{[4-(dimethylamino)phenyl]methyl}-1-(4-fluorobenzene-1-sulfonyl)-3-(furan-2-yl)-1H-1,2,4-triazol-5-amine
N-{[4-(dimethylamino)phenyl]methyl}-1-(4-fluorobenzene-1-sulfonyl)-3-(furan-2-yl)-1H-1,2,4-triazol-5-amine
Compound characteristics
| Compound ID: | D331-0282 |
| Compound Name: | N-{[4-(dimethylamino)phenyl]methyl}-1-(4-fluorobenzene-1-sulfonyl)-3-(furan-2-yl)-1H-1,2,4-triazol-5-amine |
| Molecular Weight: | 441.48 |
| Molecular Formula: | C21 H20 F N5 O3 S |
| Smiles: | CN(C)c1ccc(CNc2nc(c3ccco3)nn2S(c2ccc(cc2)F)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4562 |
| logD: | 3.4408 |
| logSw: | -3.9306 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.617 |
| InChI Key: | GXOBZHBMAVNDLV-UHFFFAOYSA-N |