AC1MF1HC
2-ethylsulfanylethyl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: SR-01000431560-1|2-(ethylsulfanyl)ethyl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate|2-(ethylthio)ethyl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate|2-ethylsulfanylethyl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate|2-ethylthioethyl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-7-(4-chlorophenyl)-2-met hyl-5-oxo-1,4,6,7,8-pentahydroquinoline-3-carboxylate
| Molecular Formula | C29H31BrClNO5S |
|---|---|
| Molecular Weight | 619.07947 g/mol |
| LogP | 6.8647 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 619.07947 |
| Monoisotopic Mass | 619.07947 |
| Heavy Atoms | 38 |
| Complexity | 1290.6188 |
Chemical Identifiers
| CAS Number | 312596-95-5 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)C2C3=C(CC(CC3=O)C4=CC=C(C=C4)Cl)NC(=C2C(=O)OCCSCC)C)Br)O |
Product Overview
AC1MF1HC (CAS 312596-95-5), with molecular formula C29H31BrClNO5S and molecular weight 619.07947 g/mol. IUPAC: 2-ethylsulfanylethyl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-7-(4-chlorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
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