N-[3-(1-methyl-1H-benzimidazol-2-yl)propyl]-4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexane-1-carboxamide
Chemical Structure Depiction of
N-[3-(1-methyl-1H-benzimidazol-2-yl)propyl]-4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexane-1-carboxamide
N-[3-(1-methyl-1H-benzimidazol-2-yl)propyl]-4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | D757-0155 |
| Compound Name: | N-[3-(1-methyl-1H-benzimidazol-2-yl)propyl]-4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexane-1-carboxamide |
| Molecular Weight: | 444.58 |
| Molecular Formula: | C27 H32 N4 O2 |
| Smiles: | Cn1c2ccccc2nc1CCCNC([C@H]1CC[C@@H](CC1)CN1Cc2ccccc2C1=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.8608 |
| logD: | 3.8199 |
| logSw: | -3.9293 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.318 |
| InChI Key: | IXAIXGRJSKPPGR-UHFFFAOYSA-N |