N-{3-[benzyl(butyl)amino]propyl}-2-[(3-chlorophenyl)sulfanyl]quinoline-4-carboxamide
Chemical Structure Depiction of
N-{3-[benzyl(butyl)amino]propyl}-2-[(3-chlorophenyl)sulfanyl]quinoline-4-carboxamide
N-{3-[benzyl(butyl)amino]propyl}-2-[(3-chlorophenyl)sulfanyl]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | K786-9106 |
| Compound Name: | N-{3-[benzyl(butyl)amino]propyl}-2-[(3-chlorophenyl)sulfanyl]quinoline-4-carboxamide |
| Molecular Weight: | 518.12 |
| Molecular Formula: | C30 H32 Cl N3 O S |
| Smiles: | CCCCN(CCCNC(c1cc(nc2ccccc12)Sc1cccc(c1)[Cl])=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 7.6057 |
| logD: | 6.0432 |
| logSw: | -6.3188 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.854 |
| InChI Key: | SUVBBOOTXPHYCT-UHFFFAOYSA-N |