2-({4-[4-(1,3-benzoxazol-2-yl)piperidine-1-carbonyl]cyclohexyl}methyl)-2,3-dihydro-1H-isoindol-1-one
Chemical Structure Depiction of
2-({4-[4-(1,3-benzoxazol-2-yl)piperidine-1-carbonyl]cyclohexyl}methyl)-2,3-dihydro-1H-isoindol-1-one
2-({4-[4-(1,3-benzoxazol-2-yl)piperidine-1-carbonyl]cyclohexyl}methyl)-2,3-dihydro-1H-isoindol-1-one
Compound characteristics
| Compound ID: | D757-0034 |
| Compound Name: | 2-({4-[4-(1,3-benzoxazol-2-yl)piperidine-1-carbonyl]cyclohexyl}methyl)-2,3-dihydro-1H-isoindol-1-one |
| Molecular Weight: | 457.57 |
| Molecular Formula: | C28 H31 N3 O3 |
| Smiles: | C1CN(CCC1c1nc2ccccc2o1)C([C@@H]1CC[C@H](CC1)CN1Cc2ccccc2C1=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 5.1038 |
| logD: | 5.1038 |
| logSw: | -5.2104 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.535 |
| InChI Key: | ABXBGHKWLVKUDD-UHFFFAOYSA-N |