1-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-(2-nitrophenoxy)ethan-1-one
Chemical Structure Depiction of
1-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-(2-nitrophenoxy)ethan-1-one
1-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-(2-nitrophenoxy)ethan-1-one
Compound characteristics
| Compound ID: | 3390-0180 |
| Compound Name: | 1-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-2-(2-nitrophenoxy)ethan-1-one |
| Molecular Weight: | 374.39 |
| Molecular Formula: | C22 H18 N2 O4 |
| Smiles: | C1Cc2ccccc2N(C(COc2ccccc2[N+]([O-])=O)=O)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 4.5957 |
| logD: | 4.5957 |
| logSw: | -4.5756 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.34 |
| InChI Key: | VAUWKHMPJXNDKA-UHFFFAOYSA-N |