methyl 3-{[8-methoxy-2-(thiomorpholine-4-carbonyl)quinolin-4-yl]amino}benzoate
Chemical Structure Depiction of
methyl 3-{[8-methoxy-2-(thiomorpholine-4-carbonyl)quinolin-4-yl]amino}benzoate
methyl 3-{[8-methoxy-2-(thiomorpholine-4-carbonyl)quinolin-4-yl]amino}benzoate
Compound characteristics
| Compound ID: | L485-4044 |
| Compound Name: | methyl 3-{[8-methoxy-2-(thiomorpholine-4-carbonyl)quinolin-4-yl]amino}benzoate |
| Molecular Weight: | 437.52 |
| Molecular Formula: | C23 H23 N3 O4 S |
| Smiles: | COC(c1cccc(c1)Nc1cc(C(N2CCSCC2)=O)nc2c(cccc12)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5917 |
| logD: | 4.5917 |
| logSw: | -4.4443 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.007 |
| InChI Key: | ZKGPTFGNZHBNLN-UHFFFAOYSA-N |