methyl 4-[3-(4-methylphenyl)-1-oxo-10-(3,4,5-trimethoxybenzoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl]benzoate
Chemical Structure Depiction of
methyl 4-[3-(4-methylphenyl)-1-oxo-10-(3,4,5-trimethoxybenzoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl]benzoate
methyl 4-[3-(4-methylphenyl)-1-oxo-10-(3,4,5-trimethoxybenzoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl]benzoate
Compound characteristics
| Compound ID: | 8012-4673 |
| Compound Name: | methyl 4-[3-(4-methylphenyl)-1-oxo-10-(3,4,5-trimethoxybenzoyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl]benzoate |
| Molecular Weight: | 632.71 |
| Molecular Formula: | C38 H36 N2 O7 |
| Smiles: | Cc1ccc(cc1)C1CC2=C(C(c3ccc(cc3)C(=O)OC)N(C(c3cc(c(c(c3)OC)OC)OC)=O)c3ccccc3N2)C(C1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.9012 |
| logD: | 6.8593 |
| logSw: | -5.6497 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.045 |
| InChI Key: | QHALWPNBLRJJLP-UHFFFAOYSA-N |