ethyl 4-{2-[(5-methoxy-2-{[(pyrimidin-2-yl)sulfanyl]methyl}pyridin-4-yl)oxy]acetamido}benzoate
Chemical Structure Depiction of
ethyl 4-{2-[(5-methoxy-2-{[(pyrimidin-2-yl)sulfanyl]methyl}pyridin-4-yl)oxy]acetamido}benzoate
ethyl 4-{2-[(5-methoxy-2-{[(pyrimidin-2-yl)sulfanyl]methyl}pyridin-4-yl)oxy]acetamido}benzoate
Compound characteristics
| Compound ID: | G862-0382 |
| Compound Name: | ethyl 4-{2-[(5-methoxy-2-{[(pyrimidin-2-yl)sulfanyl]methyl}pyridin-4-yl)oxy]acetamido}benzoate |
| Molecular Weight: | 454.5 |
| Molecular Formula: | C22 H22 N4 O5 S |
| Smiles: | CCOC(c1ccc(cc1)NC(COc1cc(CSc2ncccn2)ncc1OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9594 |
| logD: | 2.9583 |
| logSw: | -3.3936 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.605 |
| InChI Key: | WVSSSAZEWKKUPB-UHFFFAOYSA-N |