N-[(2S)-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenylpropyl]-2-[3-(4H-1,2,4-triazol-4-yl)phenoxy]acetamide
Chemical Structure Depiction of
N-[(2S)-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenylpropyl]-2-[3-(4H-1,2,4-triazol-4-yl)phenoxy]acetamide
N-[(2S)-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenylpropyl]-2-[3-(4H-1,2,4-triazol-4-yl)phenoxy]acetamide
Compound characteristics
| Compound ID: | D754-0176 |
| Compound Name: | N-[(2S)-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenylpropyl]-2-[3-(4H-1,2,4-triazol-4-yl)phenoxy]acetamide |
| Molecular Weight: | 467.53 |
| Molecular Formula: | C27 H25 N5 O3 |
| Smiles: | C([C@@H](CN1Cc2ccccc2C1=O)c1ccccc1)NC(COc1cccc(c1)n1cnnc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.9567 |
| logD: | 2.9567 |
| logSw: | -3.4864 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.616 |
| InChI Key: | FUHGPNNHUCWNBX-QFIPXVFZSA-N |