3-(furan-2-yl)-1-(4-methylbenzene-1-sulfonyl)-N-[(5-methylfuran-2-yl)methyl]-1H-1,2,4-triazol-5-amine
Chemical Structure Depiction of
3-(furan-2-yl)-1-(4-methylbenzene-1-sulfonyl)-N-[(5-methylfuran-2-yl)methyl]-1H-1,2,4-triazol-5-amine
3-(furan-2-yl)-1-(4-methylbenzene-1-sulfonyl)-N-[(5-methylfuran-2-yl)methyl]-1H-1,2,4-triazol-5-amine
Compound characteristics
| Compound ID: | D331-0109 |
| Compound Name: | 3-(furan-2-yl)-1-(4-methylbenzene-1-sulfonyl)-N-[(5-methylfuran-2-yl)methyl]-1H-1,2,4-triazol-5-amine |
| Molecular Weight: | 398.44 |
| Molecular Formula: | C19 H18 N4 O4 S |
| Smiles: | Cc1ccc(cc1)S(n1c(NCc2ccc(C)o2)nc(c2ccco2)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.818 |
| logD: | 3.818 |
| logSw: | -3.9233 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.075 |
| InChI Key: | MRGPCBRBBJXPJI-UHFFFAOYSA-N |