ethyl 1-[3-(3-chloro-4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carbonyl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[3-(3-chloro-4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carbonyl]piperidine-4-carboxylate
ethyl 1-[3-(3-chloro-4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carbonyl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | C507-0033 |
| Compound Name: | ethyl 1-[3-(3-chloro-4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carbonyl]piperidine-4-carboxylate |
| Molecular Weight: | 522.99 |
| Molecular Formula: | C27 H27 Cl N4 O5 |
| Smiles: | CCOC(C1CCN(CC1)C(C1c2c3ccccc3n(C)c2C(N(c2ccc(c(c2)[Cl])OC)N=1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6629 |
| logD: | 3.6629 |
| logSw: | -4.5073 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.003 |
| InChI Key: | MLUKBEQUJQRLMF-UHFFFAOYSA-N |