N-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-2-(3,4-dimethoxyanilino)quinoline-4-carboxamide
Chemical Structure Depiction of
N-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-2-(3,4-dimethoxyanilino)quinoline-4-carboxamide
N-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-2-(3,4-dimethoxyanilino)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | C387-0077 |
| Compound Name: | N-{2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl}-2-(3,4-dimethoxyanilino)quinoline-4-carboxamide |
| Molecular Weight: | 546.07 |
| Molecular Formula: | C30 H32 Cl N5 O3 |
| Smiles: | COc1ccc(cc1OC)Nc1cc(C(NCCN2CCN(CC2)c2cccc(c2)[Cl])=O)c2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 5.2848 |
| logD: | 5.2607 |
| logSw: | -5.7903 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.807 |
| InChI Key: | NDNDBHIKUUCLFZ-UHFFFAOYSA-N |