[5-{[(4-chlorophenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](4-methylphenyl)methanone
Chemical Structure Depiction of
[5-{[(4-chlorophenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](4-methylphenyl)methanone
[5-{[(4-chlorophenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](4-methylphenyl)methanone
Compound characteristics
| Compound ID: | D116-0127 |
| Compound Name: | [5-{[(4-chlorophenyl)methyl]amino}-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl](4-methylphenyl)methanone |
| Molecular Weight: | 392.84 |
| Molecular Formula: | C21 H17 Cl N4 O2 |
| Smiles: | Cc1ccc(cc1)C(n1c(NCc2ccc(cc2)[Cl])nc(c2ccco2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4545 |
| logD: | 4.4545 |
| logSw: | -4.6441 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.806 |
| InChI Key: | JLHAWXRBUHZIGV-UHFFFAOYSA-N |