9b-(4-chlorophenyl)-1-[(4-chlorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;9b-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one

C140H116Cl5F3N12O6 — CID 158995367

IUPAC9b-(4-chlorophenyl)-1-[(4-chlorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;9b-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one
SMILESCc1ccc(C23c4ccccc4C(=O)N2CCN3Cc2ccc(Cl)cc2)cc1.Cc1ccc(C23c4ccccc4C(=O)N2CCN3Cc2ccc(F)cc2)cc1.O=C1c2ccccc2C2(c3ccc(Cl)cc3)N(Cc3ccc(Cl)cc3)CCN12.O=C1c2ccccc2C2(c3ccc(Cl)cc3)N(Cc3ccc(F)cc3)CCN12.O=C1c2ccccc2C2(c3ccccc3)N(Cc3ccc(Cl)cc3)CCN12.O=C1c2ccccc2C2(c3ccccc3)N(Cc3ccc(F)cc3)CCN12
InChIInChI=1S/C24H21ClN2O.C24H21FN2O.C23H18Cl2N2O.C23H18ClFN2O.C23H19ClN2O.C23H19FN2O/c2*1-17-6-10-19(11-7-17)24-22-5-3-2-4-21(22)23(28)27(24)15-14-26(24)16-18-8-12-20(25)13-9-18;24-18-9-5-16(6-10-18)15-26-13-14-27-22(28)20-3-1-2-4-21(20)23(26,27)17-7-11-19(25)12-8-17;24-18-9-7-17(8-10-18)23-21-4-2-1-3-20(21)22(28)27(23)14-13-26(23)15-16-5-11-19(25)12-6-16;2*24-19-12-10-17(11-13-19)16-25-14-15-26-22(27)20-8-4-5-9-21(20)23(25,26)18-6-2-1-3-7-18/h2*2-13H,14-16H2,1H3;2*1-12H,13-15H2;2*1-13H,14-16H2
InChIKeyJQRFAEHVWXZNJS-UHFFFAOYSA-N
MW2296.80 g/mol
LogP27.46
Rot. Bonds18

About 9b-(4-chlorophenyl)-1-[(4-chlorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;9b-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one

9b-(4-chlorophenyl)-1-[(4-chlorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;9b-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one (PubChem CID 158995367) has the molecular formula C140H116Cl5F3N12O6 and a molecular weight of 2296.80 g/mol. Its IUPAC name is 9b-(4-chlorophenyl)-1-[(4-chlorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;9b-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one.

Molecular Properties

Compound Name9b-(4-chlorophenyl)-1-[(4-chlorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;9b-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one
PubChem CID158995367
Molecular FormulaC140H116Cl5F3N12O6
Molecular Weight2296.80 g/mol
Exact Mass2292.75
IUPAC Name9b-(4-chlorophenyl)-1-[(4-chlorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;9b-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one
SMILESCc1ccc(C23c4ccccc4C(=O)N2CCN3Cc2ccc(Cl)cc2)cc1.Cc1ccc(C23c4ccccc4C(=O)N2CCN3Cc2ccc(F)cc2)cc1.O=C1c2ccccc2C2(c3ccc(Cl)cc3)N(Cc3ccc(Cl)cc3)CCN12.O=C1c2ccccc2C2(c3ccc(Cl)cc3)N(Cc3ccc(F)cc3)CCN12.O=C1c2ccccc2C2(c3ccccc3)N(Cc3ccc(Cl)cc3)CCN12.O=C1c2ccccc2C2(c3ccccc3)N(Cc3ccc(F)cc3)CCN12
InChIInChI=1S/C24H21ClN2O.C24H21FN2O.C23H18Cl2N2O.C23H18ClFN2O.C23H19ClN2O.C23H19FN2O/c2*1-17-6-10-19(11-7-17)24-22-5-3-2-4-21(22)23(28)27(24)15-14-26(24)16-18-8-12-20(25)13-9-18;24-18-9-5-16(6-10-18)15-26-13-14-27-22(28)20-3-1-2-4-21(20)23(26,27)17-7-11-19(25)12-8-17;24-18-9-7-17(8-10-18)23-21-4-2-1-3-20(21)22(28)27(23)14-13-26(23)15-16-5-11-19(25)12-6-16;2*24-19-12-10-17(11-13-19)16-25-14-15-26-22(27)20-8-4-5-9-21(20)23(25,26)18-6-2-1-3-7-18/h2*2-13H,14-16H2,1H3;2*1-12H,13-15H2;2*1-13H,14-16H2
InChIKeyJQRFAEHVWXZNJS-UHFFFAOYSA-N
XLogP27.46
TPSA141.30 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds18
Heavy Atoms166
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002296.80
LogP ≤ 527.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 9b-(4-chlorophenyl)-1-[(4-chlorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;9b-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one with MolForge

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Related Compounds

1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one
CID 59025933
9b-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one
CID 59025936
1-[(4-fluorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one
CID 59025703
1-benzyl-10b-(4-methylphenyl)-3,4-dihydro-2H-pyrimido[2,1-a]isoindol-6-one
CID 59025836
1-benzyl-10b-(4-chlorophenyl)-3,4-dihydro-2H-pyrimido[2,1-a]isoindol-6-one
CID 59025765
2-(4-chlorophenyl)-3-[(4-fluorophenyl)methyl]-3,6,11-triazatricyclo[6.4.0.02,6]dodeca-1(8),9,11-trien-7-one
CID 59025986
9b-(4-chlorophenyl)-1-(4-methylbenzoyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one
CID 3724239
11b-(4-chlorophenyl)-1-(4-fluorobenzoyl)-2,3,4,5-tetrahydro-[1,3]diazepino[2,1-a]isoindol-7-one
CID 59026057
(3S,9bS)-1-benzyl-9b-(4-chlorophenyl)-3-methyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one
CID 71737738
3-(4-chlorophenyl)-3-methyl-2-[(4-methylphenyl)methyl]isoindol-1-one
CID 134463019
9b-(4-chlorophenyl)-1-(2,2,2-trifluoroacetyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one
CID 59026070
9b-(4-chlorophenyl)-1-(2-methoxyacetyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one
CID 59025950

Frequently Asked Questions

What is the IUPAC name of 9b-(4-chlorophenyl)-1-[(4-chlorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;9b-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one?
The IUPAC name of 9b-(4-chlorophenyl)-1-[(4-chlorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;9b-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one (CID 158995367) is 9b-(4-chlorophenyl)-1-[(4-chlorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;9b-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one.
What is the SMILES notation for 9b-(4-chlorophenyl)-1-[(4-chlorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;9b-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one?
The canonical SMILES for 9b-(4-chlorophenyl)-1-[(4-chlorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;9b-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one is Cc1ccc(C23c4ccccc4C(=O)N2CCN3Cc2ccc(Cl)cc2)cc1.Cc1ccc(C23c4ccccc4C(=O)N2CCN3Cc2ccc(F)cc2)cc1.O=C1c2ccccc2C2(c3ccc(Cl)cc3)N(Cc3ccc(Cl)cc3)CCN12.O=C1c2ccccc2C2(c3ccc(Cl)cc3)N(Cc3ccc(F)cc3)CCN12.O=C1c2ccccc2C2(c3ccccc3)N(Cc3ccc(Cl)cc3)CCN12.O=C1c2ccccc2C2(c3ccccc3)N(Cc3ccc(F)cc3)CCN12.
What is the InChIKey of 9b-(4-chlorophenyl)-1-[(4-chlorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;9b-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one?
The InChIKey is JQRFAEHVWXZNJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21ClN2O.C24H21FN2O.C23H18Cl2N2O.C23H18ClFN2O.C23H19ClN2O.C23H19FN2O/c2*1-17-6-10-19(11-7-17)24-22-5-3-2-4-21(22)23(28)27(24)15-14-26(24)16-18-8-12-20(25)13-9-18;24-18-9-5-16(6-10-18)15-26-13-14-27-22(28)20-3-1-2-4-21(20)23(26,27)17-7-11-19(25)12-8-17;24-18-9-7-17(8-10-18)23-21-4-2-1-3-20(21)22(28)27(23)14-13-26(23)15-16-5-11-19(25)12-6-16;2*24-19-12-10-17(11-13-19)16-25-14-15-26-22(27)20-8-4-5-9-21(20)23(25,26)18-6-2-1-3-7-18/h2*2-13H,14-16H2,1H3;2*1-12H,13-15H2;2*1-13H,14-16H2.
What are the key properties of 9b-(4-chlorophenyl)-1-[(4-chlorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;9b-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one?
9b-(4-chlorophenyl)-1-[(4-chlorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;9b-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one has a molecular weight of 2296.80 g/mol, XLogP of 27.46, 18 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 9b-(4-chlorophenyl)-1-[(4-chlorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;9b-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-chlorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-(4-methylphenyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one;1-[(4-fluorophenyl)methyl]-9b-phenyl-2,3-dihydroimidazo[2,1-a]isoindol-5-one is sourced from PubChem (CID 158995367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).