(1r,4S)-N-[(2S)-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenylpropyl]-4-[(1H-tetrazol-1-yl)methyl]cyclohexane-1-carboxamide
Chemical Structure Depiction of
(1r,4S)-N-[(2S)-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenylpropyl]-4-[(1H-tetrazol-1-yl)methyl]cyclohexane-1-carboxamide
(1r,4S)-N-[(2S)-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenylpropyl]-4-[(1H-tetrazol-1-yl)methyl]cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | D754-0198 |
| Compound Name: | (1r,4S)-N-[(2S)-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-2-phenylpropyl]-4-[(1H-tetrazol-1-yl)methyl]cyclohexane-1-carboxamide |
| Molecular Weight: | 458.56 |
| Molecular Formula: | C26 H30 N6 O2 |
| Smiles: | C1C[C@@H](CC[C@H]1Cn1cnnn1)C(NC[C@@H](CN1Cc2ccccc2C1=O)c1ccccc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.7744 |
| logD: | 3.7744 |
| logSw: | -4.1423 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.404 |
| InChI Key: | LVTPXPBKXOFICQ-IRSIHTCSSA-N |