N-(3-chloro-4-fluorophenyl)-2-(2-methoxyethyl)-3-(1-methyl-1H-indol-3-yl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2-(2-methoxyethyl)-3-(1-methyl-1H-indol-3-yl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
N-(3-chloro-4-fluorophenyl)-2-(2-methoxyethyl)-3-(1-methyl-1H-indol-3-yl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C294-0486 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2-(2-methoxyethyl)-3-(1-methyl-1H-indol-3-yl)-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 505.98 |
| Molecular Formula: | C28 H25 Cl F N3 O3 |
| Smiles: | Cn1cc(C2C(C(Nc3ccc(c(c3)[Cl])F)=O)c3ccccc3C(N2CCOC)=O)c2ccccc12 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7362 |
| logD: | 4.4284 |
| logSw: | -4.8265 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.894 |
| InChI Key: | SZUOFWJVKSMZDR-UHFFFAOYSA-N |