AC1N5J7A
N-(4-chlorophenyl)-2-[[3-(3-chlorophenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide
Also Known As: Oprea1_049189|F0580-0836|N-(4-chlorophenyl)-2-{[3-(3-chlorophenyl)-4-oxo-3H,4H,5H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetamide|N-(4-chlorophenyl)-2-((3-(3-chlorophenyl)-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)thio)acetamide|N-(4-chlorophenyl)-2-[[3-(3-chlorophenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide
| Molecular Formula | C24H16Cl2N4O2S |
|---|---|
| Molecular Weight | 494.0371 g/mol |
| LogP | 5.9046 |
| Topological Polar Surface Area | 79.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 494.0371 |
| Monoisotopic Mass | 494.0371 |
| Heavy Atoms | 33 |
| Complexity | 1561.1466 |
Chemical Identifiers
| CAS Number | 536714-06-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=C(N2)C(=O)N(C(=N3)SCC(=O)NC4=CC=C(C=C4)Cl)C5=CC(=CC=C5)Cl |
Product Overview
AC1N5J7A (CAS 536714-06-4), with molecular formula C24H16Cl2N4O2S and molecular weight 494.0371 g/mol. IUPAC: N-(4-chlorophenyl)-2-[[3-(3-chlorophenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide.
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