2-{1-[(3,4-dichlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-2,3-dihydro-1H-isoindol-1-one
Chemical Structure Depiction of
2-{1-[(3,4-dichlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-2,3-dihydro-1H-isoindol-1-one
2-{1-[(3,4-dichlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-2,3-dihydro-1H-isoindol-1-one
Compound characteristics
| Compound ID: | Y501-2577 |
| Compound Name: | 2-{1-[(3,4-dichlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-2,3-dihydro-1H-isoindol-1-one |
| Molecular Weight: | 359.21 |
| Molecular Formula: | C17 H12 Cl2 N4 O |
| Smiles: | C1c2ccccc2C(N1c1ncn(Cc2ccc(c(c2)[Cl])[Cl])n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.114 |
| logD: | 4.114 |
| logSw: | -4.3458 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 39.453 |
| InChI Key: | WBDBUGVYJGLFCS-UHFFFAOYSA-N |