9,9-dimethyl-12-(3-nitrophenyl)-8,9,10,12-tetrahydrobenzo[a]acridin-11(7H)-one
Chemical Structure Depiction of
9,9-dimethyl-12-(3-nitrophenyl)-8,9,10,12-tetrahydrobenzo[a]acridin-11(7H)-one
9,9-dimethyl-12-(3-nitrophenyl)-8,9,10,12-tetrahydrobenzo[a]acridin-11(7H)-one
Compound characteristics
| Compound ID: | 1781-2045 |
| Compound Name: | 9,9-dimethyl-12-(3-nitrophenyl)-8,9,10,12-tetrahydrobenzo[a]acridin-11(7H)-one |
| Molecular Weight: | 398.46 |
| Molecular Formula: | C25 H22 N2 O3 |
| Smiles: | CC1(C)CC2=C(C(c3cccc(c3)[N+]([O-])=O)c3c(ccc4ccccc34)N2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6122 |
| logD: | 5.6054 |
| logSw: | -6.7302 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.38 |
| InChI Key: | IMCSTOUGZDWKJG-QFIPXVFZSA-N |