1-(4-chlorobenzene-1-sulfonyl)-3-(furan-2-yl)-N-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine
Chemical Structure Depiction of
1-(4-chlorobenzene-1-sulfonyl)-3-(furan-2-yl)-N-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine
1-(4-chlorobenzene-1-sulfonyl)-3-(furan-2-yl)-N-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine
Compound characteristics
| Compound ID: | D116-0101 |
| Compound Name: | 1-(4-chlorobenzene-1-sulfonyl)-3-(furan-2-yl)-N-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazol-5-amine |
| Molecular Weight: | 444.89 |
| Molecular Formula: | C20 H17 Cl N4 O4 S |
| Smiles: | COc1ccc(CNc2nc(c3ccco3)nn2S(c2ccc(cc2)[Cl])(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9142 |
| logD: | 3.9142 |
| logSw: | -4.4261 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.356 |
| InChI Key: | ZROONTZXTJBZEM-UHFFFAOYSA-N |