2-ethoxy-4-(3,3,7,8-tetramethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)phenyl cyclopropanecarboxylate
Chemical Structure Depiction of
2-ethoxy-4-(3,3,7,8-tetramethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)phenyl cyclopropanecarboxylate
2-ethoxy-4-(3,3,7,8-tetramethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)phenyl cyclopropanecarboxylate
Compound characteristics
Compound ID: | 3490-5527 |
Compound Name: | 2-ethoxy-4-(3,3,7,8-tetramethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)phenyl cyclopropanecarboxylate |
Molecular Weight: | 474.6 |
Molecular Formula: | C29 H34 N2 O4 |
Smiles: | CCOc1cc(ccc1OC(C1CC1)=O)C1C2=C(CC(C)(C)CC2=O)Nc2cc(C)c(C)cc2N1 |
Stereo: | RACEMIC MIXTURE |
logP: | 5.3737 |
logD: | 5.3645 |
logSw: | -5.4574 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 64.946 |
InChI Key: | YZDRUFGBFNSKOU-MHZLTWQESA-N |