ethyl 4-{[3-(3-chloro-4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carbonyl]amino}piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{[3-(3-chloro-4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carbonyl]amino}piperidine-1-carboxylate
ethyl 4-{[3-(3-chloro-4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carbonyl]amino}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | C507-0191 |
| Compound Name: | ethyl 4-{[3-(3-chloro-4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carbonyl]amino}piperidine-1-carboxylate |
| Molecular Weight: | 538 |
| Molecular Formula: | C27 H28 Cl N5 O5 |
| Smiles: | CCOC(N1CCC(CC1)NC(C1c2c3ccccc3n(C)c2C(N(c2ccc(c(c2)[Cl])OC)N=1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7358 |
| logD: | 3.7358 |
| logSw: | -4.5919 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.52 |
| InChI Key: | RTNVBCWWOOADOS-UHFFFAOYSA-N |