N-[(2S)-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenylpropyl]-2-{1-[(1H-tetrazol-1-yl)methyl]cyclohexyl}acetamide
Chemical Structure Depiction of
N-[(2S)-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenylpropyl]-2-{1-[(1H-tetrazol-1-yl)methyl]cyclohexyl}acetamide
N-[(2S)-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenylpropyl]-2-{1-[(1H-tetrazol-1-yl)methyl]cyclohexyl}acetamide
Compound characteristics
| Compound ID: | D754-0002 |
| Compound Name: | N-[(2S)-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenylpropyl]-2-{1-[(1H-tetrazol-1-yl)methyl]cyclohexyl}acetamide |
| Molecular Weight: | 472.59 |
| Molecular Formula: | C27 H32 N6 O2 |
| Smiles: | C1CCC(CC1)(CC(NC[C@@H](CN1Cc2ccccc2C1=O)c1ccccc1)=O)Cn1cnnn1 |
| Stereo: | ABSOLUTE |
| logP: | 3.0386 |
| logD: | 3.0386 |
| logSw: | -3.3843 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.19 |
| InChI Key: | GKVGAMHCJUOKQI-QHCPKHFHSA-N |