N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-methyl-3-(4-methylphenyl)-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-methyl-3-(4-methylphenyl)-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-methyl-3-(4-methylphenyl)-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
Compound characteristics
| Compound ID: | C448-1575 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-methyl-3-(4-methylphenyl)-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide |
| Molecular Weight: | 466.5 |
| Molecular Formula: | C27 H22 N4 O4 |
| Smiles: | Cc1ccc(cc1)N1C(c2c(C(C(NCc3ccc4c(c3)OCO4)=O)=N1)c1ccccc1n2C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1199 |
| logD: | 4.1198 |
| logSw: | -4.3789 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.499 |
| InChI Key: | JPCALSNXJHEFCI-UHFFFAOYSA-N |