N-{4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexyl}-2-(3-oxo-5,6,7,8-tetrahydrocinnolin-2(3H)-yl)acetamide
Chemical Structure Depiction of
N-{4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexyl}-2-(3-oxo-5,6,7,8-tetrahydrocinnolin-2(3H)-yl)acetamide
N-{4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexyl}-2-(3-oxo-5,6,7,8-tetrahydrocinnolin-2(3H)-yl)acetamide
Compound characteristics
| Compound ID: | D753-0059 |
| Compound Name: | N-{4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexyl}-2-(3-oxo-5,6,7,8-tetrahydrocinnolin-2(3H)-yl)acetamide |
| Molecular Weight: | 434.54 |
| Molecular Formula: | C25 H30 N4 O3 |
| Smiles: | C1CCC2C(C1)=CC(N(CC(N[C@@H]1CC[C@H](CC1)CN1Cc3ccccc3C1=O)=O)N=2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3679 |
| logD: | 2.3679 |
| logSw: | -2.9233 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.076 |
| InChI Key: | YTAJYWYRSWAWAO-UHFFFAOYSA-N |