methyl 4-{2-[2-(3-chlorophenyl)-5-(2-hydroxyethyl)-4-methyl-6-oxopyrimidin-1(6H)-yl]acetamido}benzoate
Chemical Structure Depiction of
methyl 4-{2-[2-(3-chlorophenyl)-5-(2-hydroxyethyl)-4-methyl-6-oxopyrimidin-1(6H)-yl]acetamido}benzoate
methyl 4-{2-[2-(3-chlorophenyl)-5-(2-hydroxyethyl)-4-methyl-6-oxopyrimidin-1(6H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | T604-0575 |
| Compound Name: | methyl 4-{2-[2-(3-chlorophenyl)-5-(2-hydroxyethyl)-4-methyl-6-oxopyrimidin-1(6H)-yl]acetamido}benzoate |
| Molecular Weight: | 455.9 |
| Molecular Formula: | C23 H22 Cl N3 O5 |
| Smiles: | CC1=C(CCO)C(N(CC(Nc2ccc(cc2)C(=O)OC)=O)C(c2cccc(c2)[Cl])=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7889 |
| logD: | 2.7888 |
| logSw: | -3.5353 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.98 |
| InChI Key: | ODIXWTRFCKVVLD-UHFFFAOYSA-N |