AC1N612T
3-(1,3-benzodioxol-5-ylmethyl)-2-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-6-morpholin-4-ylquinazolin-4-one
Also Known As: 3-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-6-(morpholin-4-yl)-3,4-dihydroquinazolin-4-one|F0921-6816|3-(1,3-benzodioxol-5-ylmethyl)-2-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-6-morpholin-4-ylquinazolin-4-one|3-(benzo[d][1,3]dioxol-5-ylmethyl)-2-((2-(4-fluorophenyl)-2-oxoethyl)thio)-6-morpholinoquinazolin-4(3H)-one
| Molecular Formula | C28H24FN3O5S |
|---|---|
| Molecular Weight | 533.1421 g/mol |
| LogP | 4.1242 |
| Topological Polar Surface Area | 82.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 533.1421 |
| Monoisotopic Mass | 533.1421 |
| Heavy Atoms | 38 |
| Complexity | 1567.8013 |
Chemical Identifiers
| CAS Number | 689772-63-2 |
|---|---|
| SMILES | C1COCCN1C2=CC3=C(C=C2)N=C(N(C3=O)CC4=CC5=C(C=C4)OCO5)SCC(=O)C6=CC=C(C=C6)F |
Product Overview
AC1N612T (CAS 689772-63-2), with molecular formula C28H24FN3O5S and molecular weight 533.1421 g/mol. IUPAC: 3-(1,3-benzodioxol-5-ylmethyl)-2-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-6-morpholin-4-ylquinazolin-4-one.
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