11-(2H-1,3-benzodioxol-5-yl)-7-benzoyl-3-phenyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
11-(2H-1,3-benzodioxol-5-yl)-7-benzoyl-3-phenyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
11-(2H-1,3-benzodioxol-5-yl)-7-benzoyl-3-phenyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | 3096-0108 |
| Compound Name: | 11-(2H-1,3-benzodioxol-5-yl)-7-benzoyl-3-phenyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 514.58 |
| Molecular Formula: | C33 H26 N2 O4 |
| Smiles: | C1C(CC(C2C(c3ccc4c(c3)OCO4)Nc3ccc(cc3NC1=2)C(c1ccccc1)=O)=O)c1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.8961 |
| logD: | 6.8218 |
| logSw: | -6.2842 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.059 |
| InChI Key: | UTKOMRICIMQFRZ-UHFFFAOYSA-N |