AC1NCI63
N-(3-chloro-4-methylphenyl)-2-[[3-(4-methylphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide
Also Known As: Oprea1_319638|F0580-0275|N-(3-chloro-4-methylphenyl)-2-((4-oxo-3-(p-tolyl)-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)thio)acetamide|N-(3-chloro-4-methylphenyl)-2-{[3-(4-methylphenyl)-4-oxo-3H,4H,5H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetamide|N-(3-chloro-4-methylphenyl)-2-[[3-(4-methylphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide
| Molecular Formula | C26H21ClN4O2S |
|---|---|
| Molecular Weight | 488.10736 g/mol |
| LogP | 5.86804 |
| Topological Polar Surface Area | 79.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 488.10736 |
| Monoisotopic Mass | 488.10736 |
| Heavy Atoms | 34 |
| Complexity | 1605.8164 |
Chemical Identifiers
| CAS Number | 536705-22-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4N3)N=C2SCC(=O)NC5=CC(=C(C=C5)C)Cl |
Product Overview
AC1NCI63 (CAS 536705-22-3), with molecular formula C26H21ClN4O2S and molecular weight 488.10736 g/mol. IUPAC: N-(3-chloro-4-methylphenyl)-2-[[3-(4-methylphenyl)-4-oxo-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide.
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