7-(2H-1,3-benzodioxol-5-yl)-10,10-dimethyl-7,10,11,12-tetrahydrobenzo[b][1,7]phenanthrolin-8(9H)-one
Chemical Structure Depiction of
7-(2H-1,3-benzodioxol-5-yl)-10,10-dimethyl-7,10,11,12-tetrahydrobenzo[b][1,7]phenanthrolin-8(9H)-one
7-(2H-1,3-benzodioxol-5-yl)-10,10-dimethyl-7,10,11,12-tetrahydrobenzo[b][1,7]phenanthrolin-8(9H)-one
Compound characteristics
| Compound ID: | 8015-0088 |
| Compound Name: | 7-(2H-1,3-benzodioxol-5-yl)-10,10-dimethyl-7,10,11,12-tetrahydrobenzo[b][1,7]phenanthrolin-8(9H)-one |
| Molecular Weight: | 398.46 |
| Molecular Formula: | C25 H22 N2 O3 |
| Smiles: | CC1(C)CC2=C(C(c3ccc4c(c3)OCO4)c3ccc4c(cccn4)c3N2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4845 |
| logD: | 4.3113 |
| logSw: | -4.4982 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.896 |
| InChI Key: | CRZAPZBQRVDCRX-QFIPXVFZSA-N |