3-(furan-2-yl)-1-(4-methylbenzene-1-sulfonyl)-N-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-5-amine
Chemical Structure Depiction of
3-(furan-2-yl)-1-(4-methylbenzene-1-sulfonyl)-N-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-5-amine
3-(furan-2-yl)-1-(4-methylbenzene-1-sulfonyl)-N-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-5-amine
Compound characteristics
| Compound ID: | D331-0052 |
| Compound Name: | 3-(furan-2-yl)-1-(4-methylbenzene-1-sulfonyl)-N-[(4-methylphenyl)methyl]-1H-1,2,4-triazol-5-amine |
| Molecular Weight: | 408.48 |
| Molecular Formula: | C21 H20 N4 O3 S |
| Smiles: | Cc1ccc(CNc2nc(c3ccco3)nn2S(c2ccc(C)cc2)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1839 |
| logD: | 4.1839 |
| logSw: | -4.2222 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.812 |
| InChI Key: | ZKSBOGQFYLQZSR-UHFFFAOYSA-N |