2-(diethylamino)ethyl 4-{[5-methyl-3-(4-methylphenyl)-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carbonyl]amino}benzoate
Chemical Structure Depiction of
2-(diethylamino)ethyl 4-{[5-methyl-3-(4-methylphenyl)-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carbonyl]amino}benzoate
2-(diethylamino)ethyl 4-{[5-methyl-3-(4-methylphenyl)-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | C448-1636 |
| Compound Name: | 2-(diethylamino)ethyl 4-{[5-methyl-3-(4-methylphenyl)-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carbonyl]amino}benzoate |
| Molecular Weight: | 551.65 |
| Molecular Formula: | C32 H33 N5 O4 |
| Smiles: | CCN(CC)CCOC(c1ccc(cc1)NC(C1c2c3ccccc3n(C)c2C(N(c2ccc(C)cc2)N=1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.504 |
| logD: | 4.5356 |
| logSw: | -5.757 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.521 |
| InChI Key: | HTJDMNPQQKJLRS-UHFFFAOYSA-N |