5-methyl-3-(4-methylphenyl)-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
Chemical Structure Depiction of
5-methyl-3-(4-methylphenyl)-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
5-methyl-3-(4-methylphenyl)-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
Compound characteristics
| Compound ID: | C448-1612 |
| Compound Name: | 5-methyl-3-(4-methylphenyl)-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide |
| Molecular Weight: | 533.67 |
| Molecular Formula: | C33 H35 N5 O2 |
| Smiles: | Cc1ccc(cc1)N1C(c2c(C(C(NCC3CCN(CC3)Cc3cccc(C)c3)=O)=N1)c1ccccc1n2C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4762 |
| logD: | 2.9839 |
| logSw: | -5.7172 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.117 |
| InChI Key: | CUANAFDDOUZWTJ-UHFFFAOYSA-N |