methyl (2-{[6-amino-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydropyrimidin-2-yl]sulfanyl}acetamido)(phenyl)acetate
Chemical Structure Depiction of
methyl (2-{[6-amino-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydropyrimidin-2-yl]sulfanyl}acetamido)(phenyl)acetate
methyl (2-{[6-amino-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydropyrimidin-2-yl]sulfanyl}acetamido)(phenyl)acetate
Compound characteristics
| Compound ID: | 8017-7137 |
| Compound Name: | methyl (2-{[6-amino-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydropyrimidin-2-yl]sulfanyl}acetamido)(phenyl)acetate |
| Molecular Weight: | 388.44 |
| Molecular Formula: | C18 H20 N4 O4 S |
| Smiles: | COC(C(c1ccccc1)NC(CSC1=NC(C=C(N)N1CC=C)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.5169 |
| logD: | 0.5169 |
| logSw: | -1.9837 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.06 |
| InChI Key: | MIUXDCJBYOEENP-MRXNPFEDSA-N |