3-(furan-2-yl)-1-(naphthalene-2-sulfonyl)-N-{[4-(propan-2-yl)phenyl]methyl}-1H-1,2,4-triazol-5-amine
Chemical Structure Depiction of
3-(furan-2-yl)-1-(naphthalene-2-sulfonyl)-N-{[4-(propan-2-yl)phenyl]methyl}-1H-1,2,4-triazol-5-amine
3-(furan-2-yl)-1-(naphthalene-2-sulfonyl)-N-{[4-(propan-2-yl)phenyl]methyl}-1H-1,2,4-triazol-5-amine
Compound characteristics
| Compound ID: | D331-0513 |
| Compound Name: | 3-(furan-2-yl)-1-(naphthalene-2-sulfonyl)-N-{[4-(propan-2-yl)phenyl]methyl}-1H-1,2,4-triazol-5-amine |
| Molecular Weight: | 472.57 |
| Molecular Formula: | C26 H24 N4 O3 S |
| Smiles: | CC(C)c1ccc(CNc2nc(c3ccco3)nn2S(c2ccc3ccccc3c2)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.7939 |
| logD: | 5.7939 |
| logSw: | -6.5425 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.54 |
| InChI Key: | JMKRHRFDDABHKH-UHFFFAOYSA-N |