1-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-[(2,2,4-trimethyl-1,2-dihydroquinolin-6-yl)oxy]ethan-1-one
Chemical Structure Depiction of
1-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-[(2,2,4-trimethyl-1,2-dihydroquinolin-6-yl)oxy]ethan-1-one
1-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-[(2,2,4-trimethyl-1,2-dihydroquinolin-6-yl)oxy]ethan-1-one
Compound characteristics
| Compound ID: | 4582-0070 |
| Compound Name: | 1-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-[(2,2,4-trimethyl-1,2-dihydroquinolin-6-yl)oxy]ethan-1-one |
| Molecular Weight: | 424.54 |
| Molecular Formula: | C28 H28 N2 O2 |
| Smiles: | CC1=CC(C)(C)Nc2ccc(cc12)OCC(N1c2ccccc2CCc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2514 |
| logD: | 6.2513 |
| logSw: | -5.486 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.371 |
| InChI Key: | LWKRWEJLRQDWGB-UHFFFAOYSA-N |