11-(5-methylfuran-2-yl)-3-(4-methylphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
11-(5-methylfuran-2-yl)-3-(4-methylphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
11-(5-methylfuran-2-yl)-3-(4-methylphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | 8014-3564 |
| Compound Name: | 11-(5-methylfuran-2-yl)-3-(4-methylphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 384.48 |
| Molecular Formula: | C25 H24 N2 O2 |
| Smiles: | Cc1ccc(cc1)C1CC2=C(C(c3ccc(C)o3)Nc3ccccc3N2)C(C1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.5293 |
| logD: | 5.5022 |
| logSw: | -5.4941 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 44.569 |
| InChI Key: | CRIDWQJLQWLKSC-UHFFFAOYSA-N |