2-chloro-N-{4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexyl}-5-(4H-1,2,4-triazol-4-yl)benzamide
Chemical Structure Depiction of
2-chloro-N-{4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexyl}-5-(4H-1,2,4-triazol-4-yl)benzamide
2-chloro-N-{4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexyl}-5-(4H-1,2,4-triazol-4-yl)benzamide
Compound characteristics
| Compound ID: | D753-0238 |
| Compound Name: | 2-chloro-N-{4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexyl}-5-(4H-1,2,4-triazol-4-yl)benzamide |
| Molecular Weight: | 449.94 |
| Molecular Formula: | C24 H24 Cl N5 O2 |
| Smiles: | C1C[C@H](CC[C@@H]1NC(c1cc(ccc1[Cl])n1cnnc1)=O)CN1Cc2ccccc2C1=O |
| Stereo: | ABSOLUTE |
| logP: | 3.3632 |
| logD: | 3.3632 |
| logSw: | -3.892 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.055 |
| InChI Key: | XPDOLXIJFKCPNV-UHFFFAOYSA-N |