ethyl 4-{2-[(4-methoxy-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 4-{2-[(4-methoxy-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamido}benzoate
ethyl 4-{2-[(4-methoxy-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | 8018-4097 |
| Compound Name: | ethyl 4-{2-[(4-methoxy-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 363.39 |
| Molecular Formula: | C16 H17 N3 O5 S |
| Smiles: | CCOC(c1ccc(cc1)NC(CSC1NC(C=C(N=1)OC)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8196 |
| logD: | 0.8162 |
| logSw: | -2.4318 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.978 |
| InChI Key: | KLFZGULNLAKLSA-UHFFFAOYSA-N |