3-(furan-2-yl)-N-[(5-methylfuran-2-yl)methyl]-1-(naphthalene-2-sulfonyl)-1H-1,2,4-triazol-5-amine
Chemical Structure Depiction of
3-(furan-2-yl)-N-[(5-methylfuran-2-yl)methyl]-1-(naphthalene-2-sulfonyl)-1H-1,2,4-triazol-5-amine
3-(furan-2-yl)-N-[(5-methylfuran-2-yl)methyl]-1-(naphthalene-2-sulfonyl)-1H-1,2,4-triazol-5-amine
Compound characteristics
Compound ID: | D331-0114 |
Compound Name: | 3-(furan-2-yl)-N-[(5-methylfuran-2-yl)methyl]-1-(naphthalene-2-sulfonyl)-1H-1,2,4-triazol-5-amine |
Molecular Weight: | 434.47 |
Molecular Formula: | C22 H18 N4 O4 S |
Smiles: | Cc1ccc(CNc2nc(c3ccco3)nn2S(c2ccc3ccccc3c2)(=O)=O)o1 |
Stereo: | ACHIRAL |
logP: | 4.5132 |
logD: | 4.5132 |
logSw: | -4.4912 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 77.803 |
InChI Key: | ZAJFSSDZKCPIOT-UHFFFAOYSA-N |