3-(3-chloro-4-methoxyphenyl)-N-ethyl-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)-N-ethyl-5-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
3-(3-chloro-4-methoxyphenyl)-N-ethyl-5-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
Compound characteristics
| Compound ID: | C507-0133 |
| Compound Name: | 3-(3-chloro-4-methoxyphenyl)-N-ethyl-5-methyl-4-oxo-N-[3-(trifluoromethyl)phenyl]-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide |
| Molecular Weight: | 554.96 |
| Molecular Formula: | C28 H22 Cl F3 N4 O3 |
| Smiles: | CCN(C(C1c2c3ccccc3n(C)c2C(N(c2ccc(c(c2)[Cl])OC)N=1)=O)=O)c1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 5.7437 |
| logD: | 5.7437 |
| logSw: | -6.194 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.949 |
| InChI Key: | COCGGOFLDAUOGQ-UHFFFAOYSA-N |