AC1N8QLR
3-[2-(3,4-dimethoxyphenyl)ethyl]-6-morpholin-4-yl-2-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]quinazolin-4-one
Also Known As: 3-[2-(3,4-dimethoxyphenyl)ethyl]-6-(morpholin-4-yl)-2-[({4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]-3,4-dihydroquinazolin-4-one|F3168-2480|3-(3,4-dimethoxyphenethyl)-6-morpholino-2-(((4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl)thio)quinazolin-4(3H)-one|3-[2-(3,4-dimethoxyphenyl)ethyl]-6-morpholin-4-yl-2-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]quinazolin-4-one
| Molecular Formula | C31H31N5O5S |
|---|---|
| Molecular Weight | 585.2046 g/mol |
| LogP | 3.7932 |
| Topological Polar Surface Area | 100.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 585.2046 |
| Monoisotopic Mass | 585.2046 |
| Heavy Atoms | 42 |
| Complexity | 1865.5227 |
Chemical Identifiers
| CAS Number | 689760-89-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCN2C(=O)C3=C(C=CC(=C3)N4CCOCC4)N=C2SCC5=CC(=O)N6C=CC=CC6=N5)OC |
Product Overview
AC1N8QLR (CAS 689760-89-2), with molecular formula C31H31N5O5S and molecular weight 585.2046 g/mol. IUPAC: 3-[2-(3,4-dimethoxyphenyl)ethyl]-6-morpholin-4-yl-2-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]quinazolin-4-one.
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