ethyl 3-{[3-(thiomorpholine-4-carbonyl)quinolin-4-yl]amino}benzoate
Chemical Structure Depiction of
ethyl 3-{[3-(thiomorpholine-4-carbonyl)quinolin-4-yl]amino}benzoate
ethyl 3-{[3-(thiomorpholine-4-carbonyl)quinolin-4-yl]amino}benzoate
Compound characteristics
| Compound ID: | F080-1071 |
| Compound Name: | ethyl 3-{[3-(thiomorpholine-4-carbonyl)quinolin-4-yl]amino}benzoate |
| Molecular Weight: | 421.52 |
| Molecular Formula: | C23 H23 N3 O3 S |
| Smiles: | CCOC(c1cccc(c1)Nc1c(cnc2ccccc12)C(N1CCSCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0407 |
| logD: | 4.0359 |
| logSw: | -3.8741 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.01 |
| InChI Key: | LIUHJCVYIGETRS-UHFFFAOYSA-N |