methyl 4-[10-(cyclopropanecarbonyl)-1-oxo-3-phenyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl]benzoate
Chemical Structure Depiction of
methyl 4-[10-(cyclopropanecarbonyl)-1-oxo-3-phenyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl]benzoate
methyl 4-[10-(cyclopropanecarbonyl)-1-oxo-3-phenyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl]benzoate
Compound characteristics
| Compound ID: | 8012-4661 |
| Compound Name: | methyl 4-[10-(cyclopropanecarbonyl)-1-oxo-3-phenyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-11-yl]benzoate |
| Molecular Weight: | 492.57 |
| Molecular Formula: | C31 H28 N2 O4 |
| Smiles: | COC(c1ccc(cc1)C1C2=C(CC(CC2=O)c2ccccc2)Nc2ccccc2N1C(C1CC1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.0483 |
| logD: | 5.7285 |
| logSw: | -5.6577 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.59 |
| InChI Key: | YWWPINNDSJTXMZ-UHFFFAOYSA-N |