[5-{[(4-chlorophenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](3,4,5-trimethoxyphenyl)methanone
Chemical Structure Depiction of
[5-{[(4-chlorophenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](3,4,5-trimethoxyphenyl)methanone
[5-{[(4-chlorophenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](3,4,5-trimethoxyphenyl)methanone
Compound characteristics
| Compound ID: | D116-0139 |
| Compound Name: | [5-{[(4-chlorophenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](3,4,5-trimethoxyphenyl)methanone |
| Molecular Weight: | 468.9 |
| Molecular Formula: | C23 H21 Cl N4 O5 |
| Smiles: | COc1cc(cc(c1OC)OC)C(n1c(NCc2ccc(cc2)[Cl])nc(c2ccco2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7462 |
| logD: | 3.7462 |
| logSw: | -4.3128 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.783 |
| InChI Key: | QHIDTZZUDBBFLB-UHFFFAOYSA-N |