methyl 2-[(2-oxo-2-{[(2-oxo-1,2,3,4-tetrahydroquinolin-6-yl)methyl]amino}ethyl)sulfanyl]benzoate
Chemical Structure Depiction of
methyl 2-[(2-oxo-2-{[(2-oxo-1,2,3,4-tetrahydroquinolin-6-yl)methyl]amino}ethyl)sulfanyl]benzoate
methyl 2-[(2-oxo-2-{[(2-oxo-1,2,3,4-tetrahydroquinolin-6-yl)methyl]amino}ethyl)sulfanyl]benzoate
Compound characteristics
| Compound ID: | 8019-8741 |
| Compound Name: | methyl 2-[(2-oxo-2-{[(2-oxo-1,2,3,4-tetrahydroquinolin-6-yl)methyl]amino}ethyl)sulfanyl]benzoate |
| Molecular Weight: | 384.45 |
| Molecular Formula: | C20 H20 N2 O4 S |
| Smiles: | COC(c1ccccc1SCC(NCc1ccc2c(CCC(N2)=O)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0817 |
| logD: | 2.0817 |
| logSw: | -2.9658 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.433 |
| InChI Key: | UEUDBFPKWYOBQP-UHFFFAOYSA-N |