5-(3,3-dimethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)-2-ethoxyphenyl acetate
Chemical Structure Depiction of
5-(3,3-dimethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)-2-ethoxyphenyl acetate
5-(3,3-dimethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)-2-ethoxyphenyl acetate
Compound characteristics
| Compound ID: | 8009-5748 |
| Compound Name: | 5-(3,3-dimethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)-2-ethoxyphenyl acetate |
| Molecular Weight: | 420.51 |
| Molecular Formula: | C25 H28 N2 O4 |
| Smiles: | CCOc1ccc(cc1OC(C)=O)C1C2=C(CC(C)(C)CC2=O)Nc2ccccc2N1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2513 |
| logD: | 4.2408 |
| logSw: | -4.4009 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.796 |
| InChI Key: | RRDZBKRAUYEJSL-DEOSSOPVSA-N |