ethyl 4-(2-{[6-amino-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydropyrimidin-2-yl]sulfanyl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 4-(2-{[6-amino-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydropyrimidin-2-yl]sulfanyl}acetamido)benzoate
ethyl 4-(2-{[6-amino-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydropyrimidin-2-yl]sulfanyl}acetamido)benzoate
Compound characteristics
| Compound ID: | 6218-0021 |
| Compound Name: | ethyl 4-(2-{[6-amino-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydropyrimidin-2-yl]sulfanyl}acetamido)benzoate |
| Molecular Weight: | 388.44 |
| Molecular Formula: | C18 H20 N4 O4 S |
| Smiles: | CCOC(c1ccc(cc1)NC(CSC1=NC(C=C(N)N1CC=C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9569 |
| logD: | 1.9568 |
| logSw: | -2.523 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 88.966 |
| InChI Key: | OWACTENSYQLHRJ-UHFFFAOYSA-N |