11-(4-hydroxy-3-methoxy-5-nitrophenyl)-3,3,7,8-tetramethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
11-(4-hydroxy-3-methoxy-5-nitrophenyl)-3,3,7,8-tetramethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
11-(4-hydroxy-3-methoxy-5-nitrophenyl)-3,3,7,8-tetramethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
Compound ID: | 8012-9303 |
Compound Name: | 11-(4-hydroxy-3-methoxy-5-nitrophenyl)-3,3,7,8-tetramethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
Molecular Weight: | 437.49 |
Molecular Formula: | C24 H27 N3 O5 |
Smiles: | Cc1cc2c(cc1C)NC1CC(C)(C)CC(C=1C(c1cc(c(c(c1)OC)O)[N+]([O-])=O)N2)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.5244 |
logD: | 3.7114 |
logSw: | -4.3814 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 92.938 |
InChI Key: | BDXYIDKTYMVVNB-QFIPXVFZSA-N |