2-chloro-N-[(2S)-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenylpropyl]-5-(4H-1,2,4-triazol-4-yl)benzamide
Chemical Structure Depiction of
2-chloro-N-[(2S)-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenylpropyl]-5-(4H-1,2,4-triazol-4-yl)benzamide
2-chloro-N-[(2S)-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenylpropyl]-5-(4H-1,2,4-triazol-4-yl)benzamide
Compound characteristics
| Compound ID: | D754-0207 |
| Compound Name: | 2-chloro-N-[(2S)-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenylpropyl]-5-(4H-1,2,4-triazol-4-yl)benzamide |
| Molecular Weight: | 471.95 |
| Molecular Formula: | C26 H22 Cl N5 O2 |
| Smiles: | C([C@@H](CN1Cc2ccccc2C1=O)c1ccccc1)NC(c1cc(ccc1[Cl])n1cnnc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.916 |
| logD: | 3.916 |
| logSw: | -4.4451 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.33 |
| InChI Key: | WERQOJFVQCVPHH-FQEVSTJZSA-N |