ethyl 4-(2-{[6-amino-4-oxo-1-(2-phenylethyl)-1,4-dihydropyrimidin-2-yl]sulfanyl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 4-(2-{[6-amino-4-oxo-1-(2-phenylethyl)-1,4-dihydropyrimidin-2-yl]sulfanyl}acetamido)benzoate
ethyl 4-(2-{[6-amino-4-oxo-1-(2-phenylethyl)-1,4-dihydropyrimidin-2-yl]sulfanyl}acetamido)benzoate
Compound characteristics
| Compound ID: | 8014-2833 |
| Compound Name: | ethyl 4-(2-{[6-amino-4-oxo-1-(2-phenylethyl)-1,4-dihydropyrimidin-2-yl]sulfanyl}acetamido)benzoate |
| Molecular Weight: | 452.53 |
| Molecular Formula: | C23 H24 N4 O4 S |
| Smiles: | CCOC(c1ccc(cc1)NC(CSC1=NC(C=C(N)N1CCc1ccccc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1721 |
| logD: | 3.172 |
| logSw: | -3.4609 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 88.695 |
| InChI Key: | SPFSLSCBXORXAL-UHFFFAOYSA-N |