11-(5-bromo-2-methoxyphenyl)-3-(3,4-dimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
11-(5-bromo-2-methoxyphenyl)-3-(3,4-dimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
11-(5-bromo-2-methoxyphenyl)-3-(3,4-dimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | 3490-5552 |
| Compound Name: | 11-(5-bromo-2-methoxyphenyl)-3-(3,4-dimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 535.44 |
| Molecular Formula: | C28 H27 Br N2 O4 |
| Smiles: | COc1ccc(cc1C1C2=C(CC(CC2=O)c2ccc(c(c2)OC)OC)Nc2ccccc2N1)[Br] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.7873 |
| logD: | 5.771 |
| logSw: | -5.5706 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.368 |
| InChI Key: | OSRRGCGCGLWZLB-UHFFFAOYSA-N |