N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2-[3-(methylsulfanyl)anilino]quinoline-4-carboxamide
Chemical Structure Depiction of
N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2-[3-(methylsulfanyl)anilino]quinoline-4-carboxamide
N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2-[3-(methylsulfanyl)anilino]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | K788-5579 |
| Compound Name: | N-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-2-[3-(methylsulfanyl)anilino]quinoline-4-carboxamide |
| Molecular Weight: | 546.13 |
| Molecular Formula: | C30 H32 Cl N5 O S |
| Smiles: | CSc1cccc(c1)Nc1cc(C(NCCCN2CCN(CC2)c2cccc(c2)[Cl])=O)c2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 6.334 |
| logD: | 5.7902 |
| logSw: | -6.1188 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.546 |
| InChI Key: | LAOOYVNJOIURJG-UHFFFAOYSA-N |