4-[3-(4-methoxyphenyl)-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl]phenyl acetate
Chemical Structure Depiction of
4-[3-(4-methoxyphenyl)-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl]phenyl acetate
4-[3-(4-methoxyphenyl)-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl]phenyl acetate
Compound characteristics
| Compound ID: | 3705-5812 |
| Compound Name: | 4-[3-(4-methoxyphenyl)-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl]phenyl acetate |
| Molecular Weight: | 454.53 |
| Molecular Formula: | C28 H26 N2 O4 |
| Smiles: | CC(=O)Oc1ccc(cc1)C1C2=C(CC(CC2=O)c2ccc(cc2)OC)Nc2ccccc2N1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7386 |
| logD: | 4.7223 |
| logSw: | -4.5143 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.771 |
| InChI Key: | LRXXAANYTHRFMS-UHFFFAOYSA-N |