4-(3,3-dimethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)phenyl 4-methoxybenzoate
Chemical Structure Depiction of
4-(3,3-dimethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)phenyl 4-methoxybenzoate
4-(3,3-dimethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)phenyl 4-methoxybenzoate
Compound characteristics
| Compound ID: | Y020-5709 |
| Compound Name: | 4-(3,3-dimethyl-1-oxo-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl)phenyl 4-methoxybenzoate |
| Molecular Weight: | 468.55 |
| Molecular Formula: | C29 H28 N2 O4 |
| Smiles: | CC1(C)CC2=C(C(c3ccc(cc3)OC(c3ccc(cc3)OC)=O)Nc3ccccc3N2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.162 |
| logD: | 5.1514 |
| logSw: | -5.1453 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.67 |
| InChI Key: | JSCOTZHDMRVFOS-MHZLTWQESA-N |