AC1MFEQV
2-(2-methylphenyl)-5-(3-nitrophenyl)-3-thiophen-2-yl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
Also Known As: Oprea1_733887|SR-01000499300-1|2-(2-methylphenyl)-5-(3-nitrophenyl)-3-(thiophen-2-yl)-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione|F1199-0155|5-(3-nitrophenyl)-3-(thiophen-2-yl)-2-(o-tolyl)dihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione|2-(2-methylphenyl)-5-(3-nitrophenyl)-3-thiophen-2-yl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione|2(2methylphenyl)5(3nitrophenyl)3thien2yldihydro2hpyrrolo[3,4d]isoxazole4,6(3h,5h)dione|2-(2-methylphenyl)-5-(3-nitrophenyl)-3-(thiophen-2-yl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione|5-(2-methylphenyl)-2-(3-nitrophenyl)-6-(2-thienyl)-2,4,5,6,3a,6a-hexahydro-4-o xa-2,5-diazapentalene-1,3-dione
| Molecular Formula | C22H17N3O5S |
|---|---|
| Molecular Weight | 435.0889 g/mol |
| LogP | 4.01582 |
| Topological Polar Surface Area | 92.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 435.0889 |
| Monoisotopic Mass | 435.0889 |
| Heavy Atoms | 31 |
| Complexity | 1195.3717 |
Chemical Identifiers
| CAS Number | 433261-69-9 |
|---|---|
| SMILES | CC1=CC=CC=C1N2C(C3C(O2)C(=O)N(C3=O)C4=CC(=CC=C4)[N+](=O)[O-])C5=CC=CS5 |
Product Overview
AC1MFEQV (CAS 433261-69-9), with molecular formula C22H17N3O5S and molecular weight 435.0889 g/mol. IUPAC: 2-(2-methylphenyl)-5-(3-nitrophenyl)-3-thiophen-2-yl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione.