1-(3-nitro-10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)ethan-1-one
Chemical Structure Depiction of
1-(3-nitro-10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)ethan-1-one
1-(3-nitro-10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)ethan-1-one
Compound characteristics
| Compound ID: | 1646-0123 |
| Compound Name: | 1-(3-nitro-10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)ethan-1-one |
| Molecular Weight: | 282.3 |
| Molecular Formula: | C16 H14 N2 O3 |
| Smiles: | CC(N1c2ccccc2CCc2ccc(cc12)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6848 |
| logD: | 3.6848 |
| logSw: | -3.902 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.322 |
| InChI Key: | LZEJPLZDYOQHSM-UHFFFAOYSA-N |