methyl 4-[(2-{4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]benzoyl}hydrazinylidene)methyl]benzoate
Chemical Structure Depiction of
methyl 4-[(2-{4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]benzoyl}hydrazinylidene)methyl]benzoate
methyl 4-[(2-{4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]benzoyl}hydrazinylidene)methyl]benzoate
Compound characteristics
| Compound ID: | 8007-4733 |
| Compound Name: | methyl 4-[(2-{4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]benzoyl}hydrazinylidene)methyl]benzoate |
| Molecular Weight: | 427.5 |
| Molecular Formula: | C26 H25 N3 O3 |
| Smiles: | COC(c1ccc(/C=N/NC(c2ccc(CN3CCc4ccccc4C3)cc2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4768 |
| logD: | 4.1856 |
| logSw: | -4.1413 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.123 |
| InChI Key: | VMESWQXRGYWECL-UHFFFAOYSA-N |