methyl 4-(3,3-dimethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)benzoate
Chemical Structure Depiction of
methyl 4-(3,3-dimethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)benzoate
methyl 4-(3,3-dimethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)benzoate
Compound characteristics
| Compound ID: | 8009-5753 |
| Compound Name: | methyl 4-(3,3-dimethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)benzoate |
| Molecular Weight: | 376.45 |
| Molecular Formula: | C23 H24 N2 O3 |
| Smiles: | CC1(C)CC2=C(C(c3ccc(cc3)C(=O)OC)Nc3ccccc3N2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1709 |
| logD: | 4.1604 |
| logSw: | -4.4106 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.922 |
| InChI Key: | UYPRCCWAAGAZRE-NRFANRHFSA-N |