2-(diethylamino)ethyl 4-{2-[(1-ethyl-2-oxo-1,2-dihydroquinolin-4-yl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
2-(diethylamino)ethyl 4-{2-[(1-ethyl-2-oxo-1,2-dihydroquinolin-4-yl)sulfanyl]acetamido}benzoate
2-(diethylamino)ethyl 4-{2-[(1-ethyl-2-oxo-1,2-dihydroquinolin-4-yl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | C564-0226 |
| Compound Name: | 2-(diethylamino)ethyl 4-{2-[(1-ethyl-2-oxo-1,2-dihydroquinolin-4-yl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 481.61 |
| Molecular Formula: | C26 H31 N3 O4 S |
| Smiles: | CCN(CC)CCOC(c1ccc(cc1)NC(CSC1=CC(N(CC)c2ccccc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1342 |
| logD: | 3.1658 |
| logSw: | -4.11 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.952 |
| InChI Key: | NXXBBLGMRRZQME-UHFFFAOYSA-N |