3-(furan-2-yl)-11-(4-methoxyphenyl)-10-(2-methylpropanoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
3-(furan-2-yl)-11-(4-methoxyphenyl)-10-(2-methylpropanoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
3-(furan-2-yl)-11-(4-methoxyphenyl)-10-(2-methylpropanoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | J024-0432 |
| Compound Name: | 3-(furan-2-yl)-11-(4-methoxyphenyl)-10-(2-methylpropanoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 456.54 |
| Molecular Formula: | C28 H28 N2 O4 |
| Smiles: | CC(C)C(N1C(C2=C(CC(CC2=O)c2ccco2)Nc2ccccc12)c1ccc(cc1)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2647 |
| logD: | 5.0098 |
| logSw: | -5.0948 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.287 |
| InChI Key: | HLZQMRKTCBLBOV-UHFFFAOYSA-N |