10-benzoyl-3-(furan-2-yl)-11-(4-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
10-benzoyl-3-(furan-2-yl)-11-(4-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
10-benzoyl-3-(furan-2-yl)-11-(4-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | Y508-6300 |
| Compound Name: | 10-benzoyl-3-(furan-2-yl)-11-(4-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 490.56 |
| Molecular Formula: | C31 H26 N2 O4 |
| Smiles: | COc1ccc(cc1)C1C2=C(CC(CC2=O)c2ccco2)Nc2ccccc2N1C(c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.6674 |
| logD: | 5.6363 |
| logSw: | -5.6007 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.015 |
| InChI Key: | OKYRPVOIYOZDOI-UHFFFAOYSA-N |