3,3-dimethyl-11-(5-methylfuran-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
3,3-dimethyl-11-(5-methylfuran-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
3,3-dimethyl-11-(5-methylfuran-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | 3393-0129 |
| Compound Name: | 3,3-dimethyl-11-(5-methylfuran-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 358.87 |
| Molecular Formula: | C20 H22 N2 O2 |
| Salt: | HCl |
| Smiles: | Cc1ccc(C2C3=C(CC(C)(C)CC3=O)Nc3ccccc3N2)o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9091 |
| logD: | 3.8915 |
| logSw: | -4.0815 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 44.841 |
| InChI Key: | KOGCTZKGWFPLTN-IBGZPJMESA-N |