3-(3-chloro-4-methoxyphenyl)-5-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
Chemical Structure Depiction of
3-(3-chloro-4-methoxyphenyl)-5-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
3-(3-chloro-4-methoxyphenyl)-5-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
Compound characteristics
| Compound ID: | C507-0009 |
| Compound Name: | 3-(3-chloro-4-methoxyphenyl)-5-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide |
| Molecular Weight: | 526.9 |
| Molecular Formula: | C26 H18 Cl F3 N4 O3 |
| Smiles: | Cn1c2C(N(c3ccc(c(c3)[Cl])OC)N=C(C(Nc3cccc(c3)C(F)(F)F)=O)c2c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5837 |
| logD: | 5.5771 |
| logSw: | -6.2719 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.692 |
| InChI Key: | WYXAWBPKFYIGLJ-UHFFFAOYSA-N |