ethyl 4-{5-[1-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-2-(methylamino)propan-2-yl]-1H-tetrazol-1-yl}benzoate
Chemical Structure Depiction of
ethyl 4-{5-[1-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-2-(methylamino)propan-2-yl]-1H-tetrazol-1-yl}benzoate
ethyl 4-{5-[1-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-2-(methylamino)propan-2-yl]-1H-tetrazol-1-yl}benzoate
Compound characteristics
| Compound ID: | 8017-2698 |
| Compound Name: | ethyl 4-{5-[1-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-2-(methylamino)propan-2-yl]-1H-tetrazol-1-yl}benzoate |
| Molecular Weight: | 434.45 |
| Molecular Formula: | C22 H22 N6 O4 |
| Smiles: | CCOC(c1ccc(cc1)n1c(C(C)(CN2C(c3ccccc3C2=O)=O)NC)nnn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7797 |
| logD: | 2.7797 |
| logSw: | -3.1313 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.044 |
| InChI Key: | OKGNETCPZUNFFS-QFIPXVFZSA-N |