AC1NCTFB
4-[5-(4-chlorophenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzonitrile
Also Known As: 4-(5-(4-chlorophenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d]isoxazol-3-yl)benzonitrile|4-[3-(4-chlorophenyl)-2,4-dioxo-7-phenyl-6-oxa-3,7-diazabicyclo[3.3.0]oct-8-yl]benzonitrile|4-[5-(4-chlorophenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzonitrile|4-[5-(4-chlorophenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzonitrile
| Molecular Formula | C24H16ClN3O3 |
|---|---|
| Molecular Weight | 429.088 g/mol |
| LogP | 4.26278 |
| Topological Polar Surface Area | 73.64 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 429.088 |
| Monoisotopic Mass | 429.088 |
| Heavy Atoms | 31 |
| Complexity | 1189.4941 |
Chemical Identifiers
| CAS Number | 1024231-82-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(C3C(O2)C(=O)N(C3=O)C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)C#N |
Product Overview
AC1NCTFB (CAS 1024231-82-0), with molecular formula C24H16ClN3O3 and molecular weight 429.088 g/mol. IUPAC: 4-[5-(4-chlorophenyl)-4,6-dioxo-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzonitrile.
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