1-(3,5-bis{[(2,6-dichlorophenyl)methyl]amino}-1H-1,2,4-triazol-1-yl)ethan-1-one
Chemical Structure Depiction of
1-(3,5-bis{[(2,6-dichlorophenyl)methyl]amino}-1H-1,2,4-triazol-1-yl)ethan-1-one
1-(3,5-bis{[(2,6-dichlorophenyl)methyl]amino}-1H-1,2,4-triazol-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | F019-1741 |
| Compound Name: | 1-(3,5-bis{[(2,6-dichlorophenyl)methyl]amino}-1H-1,2,4-triazol-1-yl)ethan-1-one |
| Molecular Weight: | 459.16 |
| Molecular Formula: | C18 H15 Cl4 N5 O |
| Smiles: | CC(n1c(NCc2c(cccc2[Cl])[Cl])nc(NCc2c(cccc2[Cl])[Cl])n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2573 |
| logD: | 5.2572 |
| logSw: | -5.6881 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.607 |
| InChI Key: | JJBUKGJUYNKQCV-UHFFFAOYSA-N |