ethyl 4-{[6-chloro-3-(thiomorpholine-4-carbonyl)quinolin-4-yl]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[6-chloro-3-(thiomorpholine-4-carbonyl)quinolin-4-yl]amino}benzoate
ethyl 4-{[6-chloro-3-(thiomorpholine-4-carbonyl)quinolin-4-yl]amino}benzoate
Compound characteristics
| Compound ID: | F080-1275 |
| Compound Name: | ethyl 4-{[6-chloro-3-(thiomorpholine-4-carbonyl)quinolin-4-yl]amino}benzoate |
| Molecular Weight: | 455.96 |
| Molecular Formula: | C23 H22 Cl N3 O3 S |
| Smiles: | CCOC(c1ccc(cc1)Nc1c(cnc2ccc(cc12)[Cl])C(N1CCSCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6521 |
| logD: | 4.6473 |
| logSw: | -4.7361 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.01 |
| InChI Key: | LCKQONDKTSGECX-UHFFFAOYSA-N |