2-[4'-(nitromethyl)[2,3'-biquinolin]-1'(4'H)-yl]-1-phenylethan-1-one
Chemical Structure Depiction of
2-[4'-(nitromethyl)[2,3'-biquinolin]-1'(4'H)-yl]-1-phenylethan-1-one
2-[4'-(nitromethyl)[2,3'-biquinolin]-1'(4'H)-yl]-1-phenylethan-1-one
Compound characteristics
| Compound ID: | 8012-4865 |
| Compound Name: | 2-[4'-(nitromethyl)[2,3'-biquinolin]-1'(4'H)-yl]-1-phenylethan-1-one |
| Molecular Weight: | 435.48 |
| Molecular Formula: | C27 H21 N3 O3 |
| Smiles: | C(C1C(=CN(CC(c2ccccc2)=O)c2ccccc12)c1ccc2ccccc2n1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5841 |
| logD: | 4.4718 |
| logSw: | -5.1183 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.37 |
| InChI Key: | SIQZXOBVXSNEFV-QFIPXVFZSA-N |