1-[5-{[(3-chlorophenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]-2,2-diphenylethan-1-one
Chemical Structure Depiction of
1-[5-{[(3-chlorophenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]-2,2-diphenylethan-1-one
1-[5-{[(3-chlorophenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]-2,2-diphenylethan-1-one
Compound characteristics
| Compound ID: | D331-0552 |
| Compound Name: | 1-[5-{[(3-chlorophenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]-2,2-diphenylethan-1-one |
| Molecular Weight: | 468.94 |
| Molecular Formula: | C27 H21 Cl N4 O2 |
| Smiles: | C(c1cccc(c1)[Cl])Nc1nc(c2ccco2)nn1C(C(c1ccccc1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6961 |
| logD: | 5.3324 |
| logSw: | -6.1274 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.534 |
| InChI Key: | PAEHZQURWLFNRB-UHFFFAOYSA-N |