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 cyclohexanecarboxylate
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 cyclohexanecarboxylate
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 cyclohexanecarboxylate
Compound characteristics
Compound ID: | 3192-5284 |
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 cyclohexanecarboxylate |
Molecular Weight: | 516.68 |
Molecular Formula: | C32 H40 N2 O4 |
Smiles: | CCOc1cc(ccc1OC(C1CCCCC1)=O)C1C2=C(CC(C)(C)CC2=O)Nc2cc(C)c(C)cc2N1 |
Stereo: | RACEMIC MIXTURE |
logP: | 6.5911 |
logD: | 6.5819 |
logSw: | -5.6069 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 64.615 |
InChI Key: | ZBXGXCCNPHZFPI-PMERELPUSA-N |