4-bromo-2-propan-2-yl-3H-isoindol-1-one;7-bromo-2-propan-2-yl-3H-isoindol-1-one;5-butyl-2-propan-2-yl-3H-isoindol-1-one;5-but-1-ynyl-2-propan-2-yl-3H-isoindol-1-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;7-chloro-2-propan-2-yl-3H-isoindol-1-one;4-fluoro-2-propan-2-yl-3H-isoindol-1-one;methane;4-methoxy-2-propan-2-yl-3H-isoindol-1-one;7-methoxy-2-propan-2-yl-3H-isoindol-1-one;3-methoxy-1-propan-2-yl-2H-pyrrol-5-one;tris(5-methyl-2-propan-2-yl-3H-isoindol-1-one);6-methyl-2-propan-2-yl-3H-isoindol-1-one;1-oxo-2-propan-2-yl-3H-isoindole-4-carbonitrile;3-oxo-2-propan-2-yl-1H-isoindole-4-carbonitrile

C194H245Br2Cl2FN18O19 — CID 157401044

IUPAC4-bromo-2-propan-2-yl-3H-isoindol-1-one;7-bromo-2-propan-2-yl-3H-isoindol-1-one;5-butyl-2-propan-2-yl-3H-isoindol-1-one;5-but-1-ynyl-2-propan-2-yl-3H-isoindol-1-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;7-chloro-2-propan-2-yl-3H-isoindol-1-one;4-fluoro-2-propan-2-yl-3H-isoindol-1-one;methane;4-methoxy-2-propan-2-yl-3H-isoindol-1-one;7-methoxy-2-propan-2-yl-3H-isoindol-1-one;3-methoxy-1-propan-2-yl-2H-pyrrol-5-one;tris(5-methyl-2-propan-2-yl-3H-isoindol-1-one);6-methyl-2-propan-2-yl-3H-isoindol-1-one;1-oxo-2-propan-2-yl-3H-isoindole-4-carbonitrile;3-oxo-2-propan-2-yl-1H-isoindole-4-carbonitrile
SMILESC.C.C.C.C.CC(C)N1Cc2c(Br)cccc2C1=O.CC(C)N1Cc2c(C#N)cccc2C1=O.CC(C)N1Cc2c(Cl)cccc2C1=O.CC(C)N1Cc2c(F)cccc2C1=O.CC(C)N1Cc2cccc(Br)c2C1=O.CC(C)N1Cc2cccc(C#N)c2C1=O.CC(C)N1Cc2cccc(Cl)c2C1=O.CCC#Cc1ccc2c(c1)CN(C(C)C)C2=O.CCCCc1ccc2c(c1)CN(C(C)C)C2=O.COC1=CC(=O)N(C(C)C)C1.COc1cccc2c1C(=O)N(C(C)C)C2.COc1cccc2c1CN(C(C)C)C2=O.Cc1ccc2c(c1)C(=O)N(C(C)C)C2.Cc1ccc2c(c1)CN(C(C)C)C2=O.Cc1ccc2c(c1)CN(C(C)C)C2=O.Cc1ccc2c(c1)CN(C(C)C)C2=O
InChIInChI=1S/C15H21NO.C15H17NO.2C12H12N2O.2C12H15NO2.4C12H15NO.2C11H12BrNO.2C11H12ClNO.C11H12FNO.C8H13NO2.5CH4/c2*1-4-5-6-12-7-8-14-13(9-12)10-16(11(2)3)15(14)17;1-8(2)14-7-11-9(6-13)4-3-5-10(11)12(14)15;1-8(2)14-7-10-5-3-4-9(6-13)11(10)12(14)15;1-8(2)13-7-10-9(12(13)14)5-4-6-11(10)15-3;1-8(2)13-7-9-5-4-6-10(15-3)11(9)12(13)14;3*1-8(2)13-7-10-6-9(3)4-5-11(10)12(13)14;1-8(2)13-7-10-5-4-9(3)6-11(10)12(13)14;1-7(2)13-6-9-8(11(13)14)4-3-5-10(9)12;1-7(2)13-6-8-4-3-5-9(12)10(8)11(13)14;1-7(2)13-6-9-8(11(13)14)4-3-5-10(9)12;1-7(2)13-6-8-4-3-5-9(12)10(8)11(13)14;1-7(2)13-6-9-8(11(13)14)4-3-5-10(9)12;1-6(2)9-5-7(11-3)4-8(9)10;;;;;/h7-9,11H,4-6,10H2,1-3H3;7-9,11H,4,10H2,1-3H3;2*3-5,8H,7H2,1-2H3;2*4-6,8H,7H2,1-3H3;4*4-6,8H,7H2,1-3H3;5*3-5,7H,6H2,1-2H3;4,6H,5H2,1-3H3;5*1H4
InChIKeyBNDYVUNOJKTRDZ-UHFFFAOYSA-N
MW3382.91 g/mol
LogP40.78
Rot. Bonds22

About 4-bromo-2-propan-2-yl-3H-isoindol-1-one;7-bromo-2-propan-2-yl-3H-isoindol-1-one;5-butyl-2-propan-2-yl-3H-isoindol-1-one;5-but-1-ynyl-2-propan-2-yl-3H-isoindol-1-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;7-chloro-2-propan-2-yl-3H-isoindol-1-one;4-fluoro-2-propan-2-yl-3H-isoindol-1-one;methane;4-methoxy-2-propan-2-yl-3H-isoindol-1-one;7-methoxy-2-propan-2-yl-3H-isoindol-1-one;3-methoxy-1-propan-2-yl-2H-pyrrol-5-one;tris(5-methyl-2-propan-2-yl-3H-isoindol-1-one);6-methyl-2-propan-2-yl-3H-isoindol-1-one;1-oxo-2-propan-2-yl-3H-isoindole-4-carbonitrile;3-oxo-2-propan-2-yl-1H-isoindole-4-carbonitrile

4-bromo-2-propan-2-yl-3H-isoindol-1-one;7-bromo-2-propan-2-yl-3H-isoindol-1-one;5-butyl-2-propan-2-yl-3H-isoindol-1-one;5-but-1-ynyl-2-propan-2-yl-3H-isoindol-1-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;7-chloro-2-propan-2-yl-3H-isoindol-1-one;4-fluoro-2-propan-2-yl-3H-isoindol-1-one;methane;4-methoxy-2-propan-2-yl-3H-isoindol-1-one;7-methoxy-2-propan-2-yl-3H-isoindol-1-one;3-methoxy-1-propan-2-yl-2H-pyrrol-5-one;tris(5-methyl-2-propan-2-yl-3H-isoindol-1-one);6-methyl-2-propan-2-yl-3H-isoindol-1-one;1-oxo-2-propan-2-yl-3H-isoindole-4-carbonitrile;3-oxo-2-propan-2-yl-1H-isoindole-4-carbonitrile (PubChem CID 157401044) has the molecular formula C194H245Br2Cl2FN18O19 and a molecular weight of 3382.91 g/mol. Its IUPAC name is 4-bromo-2-propan-2-yl-3H-isoindol-1-one;7-bromo-2-propan-2-yl-3H-isoindol-1-one;5-butyl-2-propan-2-yl-3H-isoindol-1-one;5-but-1-ynyl-2-propan-2-yl-3H-isoindol-1-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;7-chloro-2-propan-2-yl-3H-isoindol-1-one;4-fluoro-2-propan-2-yl-3H-isoindol-1-one;methane;4-methoxy-2-propan-2-yl-3H-isoindol-1-one;7-methoxy-2-propan-2-yl-3H-isoindol-1-one;3-methoxy-1-propan-2-yl-2H-pyrrol-5-one;tris(5-methyl-2-propan-2-yl-3H-isoindol-1-one);6-methyl-2-propan-2-yl-3H-isoindol-1-one;1-oxo-2-propan-2-yl-3H-isoindole-4-carbonitrile;3-oxo-2-propan-2-yl-1H-isoindole-4-carbonitrile.

Molecular Properties

Compound Name4-bromo-2-propan-2-yl-3H-isoindol-1-one;7-bromo-2-propan-2-yl-3H-isoindol-1-one;5-butyl-2-propan-2-yl-3H-isoindol-1-one;5-but-1-ynyl-2-propan-2-yl-3H-isoindol-1-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;7-chloro-2-propan-2-yl-3H-isoindol-1-one;4-fluoro-2-propan-2-yl-3H-isoindol-1-one;methane;4-methoxy-2-propan-2-yl-3H-isoindol-1-one;7-methoxy-2-propan-2-yl-3H-isoindol-1-one;3-methoxy-1-propan-2-yl-2H-pyrrol-5-one;tris(5-methyl-2-propan-2-yl-3H-isoindol-1-one);6-methyl-2-propan-2-yl-3H-isoindol-1-one;1-oxo-2-propan-2-yl-3H-isoindole-4-carbonitrile;3-oxo-2-propan-2-yl-1H-isoindole-4-carbonitrile
PubChem CID157401044
Molecular FormulaC194H245Br2Cl2FN18O19
Molecular Weight3382.91 g/mol
Exact Mass3377.65
IUPAC Name4-bromo-2-propan-2-yl-3H-isoindol-1-one;7-bromo-2-propan-2-yl-3H-isoindol-1-one;5-butyl-2-propan-2-yl-3H-isoindol-1-one;5-but-1-ynyl-2-propan-2-yl-3H-isoindol-1-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;7-chloro-2-propan-2-yl-3H-isoindol-1-one;4-fluoro-2-propan-2-yl-3H-isoindol-1-one;methane;4-methoxy-2-propan-2-yl-3H-isoindol-1-one;7-methoxy-2-propan-2-yl-3H-isoindol-1-one;3-methoxy-1-propan-2-yl-2H-pyrrol-5-one;tris(5-methyl-2-propan-2-yl-3H-isoindol-1-one);6-methyl-2-propan-2-yl-3H-isoindol-1-one;1-oxo-2-propan-2-yl-3H-isoindole-4-carbonitrile;3-oxo-2-propan-2-yl-1H-isoindole-4-carbonitrile
SMILESC.C.C.C.C.CC(C)N1Cc2c(Br)cccc2C1=O.CC(C)N1Cc2c(C#N)cccc2C1=O.CC(C)N1Cc2c(Cl)cccc2C1=O.CC(C)N1Cc2c(F)cccc2C1=O.CC(C)N1Cc2cccc(Br)c2C1=O.CC(C)N1Cc2cccc(C#N)c2C1=O.CC(C)N1Cc2cccc(Cl)c2C1=O.CCC#Cc1ccc2c(c1)CN(C(C)C)C2=O.CCCCc1ccc2c(c1)CN(C(C)C)C2=O.COC1=CC(=O)N(C(C)C)C1.COc1cccc2c1C(=O)N(C(C)C)C2.COc1cccc2c1CN(C(C)C)C2=O.Cc1ccc2c(c1)C(=O)N(C(C)C)C2.Cc1ccc2c(c1)CN(C(C)C)C2=O.Cc1ccc2c(c1)CN(C(C)C)C2=O.Cc1ccc2c(c1)CN(C(C)C)C2=O
InChIInChI=1S/C15H21NO.C15H17NO.2C12H12N2O.2C12H15NO2.4C12H15NO.2C11H12BrNO.2C11H12ClNO.C11H12FNO.C8H13NO2.5CH4/c2*1-4-5-6-12-7-8-14-13(9-12)10-16(11(2)3)15(14)17;1-8(2)14-7-11-9(6-13)4-3-5-10(11)12(14)15;1-8(2)14-7-10-5-3-4-9(6-13)11(10)12(14)15;1-8(2)13-7-10-9(12(13)14)5-4-6-11(10)15-3;1-8(2)13-7-9-5-4-6-10(15-3)11(9)12(13)14;3*1-8(2)13-7-10-6-9(3)4-5-11(10)12(13)14;1-8(2)13-7-10-5-4-9(3)6-11(10)12(13)14;1-7(2)13-6-9-8(11(13)14)4-3-5-10(9)12;1-7(2)13-6-8-4-3-5-9(12)10(8)11(13)14;1-7(2)13-6-9-8(11(13)14)4-3-5-10(9)12;1-7(2)13-6-8-4-3-5-9(12)10(8)11(13)14;1-7(2)13-6-9-8(11(13)14)4-3-5-10(9)12;1-6(2)9-5-7(11-3)4-8(9)10;;;;;/h7-9,11H,4-6,10H2,1-3H3;7-9,11H,4,10H2,1-3H3;2*3-5,8H,7H2,1-2H3;2*4-6,8H,7H2,1-3H3;4*4-6,8H,7H2,1-3H3;5*3-5,7H,6H2,1-2H3;4,6H,5H2,1-3H3;5*1H4
InChIKeyBNDYVUNOJKTRDZ-UHFFFAOYSA-N
XLogP40.78
TPSA400.23 Ų
H-Bond Donors
H-Bond Acceptors21
Rotatable Bonds22
Heavy Atoms236
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003382.91
LogP ≤ 540.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1021

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze 4-bromo-2-propan-2-yl-3H-isoindol-1-one;7-bromo-2-propan-2-yl-3H-isoindol-1-one;5-butyl-2-propan-2-yl-3H-isoindol-1-one;5-but-1-ynyl-2-propan-2-yl-3H-isoindol-1-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;7-chloro-2-propan-2-yl-3H-isoindol-1-one;4-fluoro-2-propan-2-yl-3H-isoindol-1-one;methane;4-methoxy-2-propan-2-yl-3H-isoindol-1-one;7-methoxy-2-propan-2-yl-3H-isoindol-1-one;3-methoxy-1-propan-2-yl-2H-pyrrol-5-one;tris(5-methyl-2-propan-2-yl-3H-isoindol-1-one);6-methyl-2-propan-2-yl-3H-isoindol-1-one;1-oxo-2-propan-2-yl-3H-isoindole-4-carbonitrile;3-oxo-2-propan-2-yl-1H-isoindole-4-carbonitrile with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-bromo-2-propan-2-yl-3H-isoindol-1-one;7-bromo-2-propan-2-yl-3H-isoindol-1-one;5-butyl-2-propan-2-yl-3H-isoindol-1-one;5-but-1-ynyl-2-propan-2-yl-3H-isoindol-1-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;7-chloro-2-propan-2-yl-3H-isoindol-1-one;4-fluoro-2-propan-2-yl-3H-isoindol-1-one;methane;4-methoxy-2-propan-2-yl-3H-isoindol-1-one;7-methoxy-2-propan-2-yl-3H-isoindol-1-one;3-methoxy-1-propan-2-yl-2H-pyrrol-5-one;tris(5-methyl-2-propan-2-yl-3H-isoindol-1-one);6-methyl-2-propan-2-yl-3H-isoindol-1-one;1-oxo-2-propan-2-yl-3H-isoindole-4-carbonitrile;3-oxo-2-propan-2-yl-1H-isoindole-4-carbonitrile?
The IUPAC name of 4-bromo-2-propan-2-yl-3H-isoindol-1-one;7-bromo-2-propan-2-yl-3H-isoindol-1-one;5-butyl-2-propan-2-yl-3H-isoindol-1-one;5-but-1-ynyl-2-propan-2-yl-3H-isoindol-1-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;7-chloro-2-propan-2-yl-3H-isoindol-1-one;4-fluoro-2-propan-2-yl-3H-isoindol-1-one;methane;4-methoxy-2-propan-2-yl-3H-isoindol-1-one;7-methoxy-2-propan-2-yl-3H-isoindol-1-one;3-methoxy-1-propan-2-yl-2H-pyrrol-5-one;tris(5-methyl-2-propan-2-yl-3H-isoindol-1-one);6-methyl-2-propan-2-yl-3H-isoindol-1-one;1-oxo-2-propan-2-yl-3H-isoindole-4-carbonitrile;3-oxo-2-propan-2-yl-1H-isoindole-4-carbonitrile (CID 157401044) is 4-bromo-2-propan-2-yl-3H-isoindol-1-one;7-bromo-2-propan-2-yl-3H-isoindol-1-one;5-butyl-2-propan-2-yl-3H-isoindol-1-one;5-but-1-ynyl-2-propan-2-yl-3H-isoindol-1-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;7-chloro-2-propan-2-yl-3H-isoindol-1-one;4-fluoro-2-propan-2-yl-3H-isoindol-1-one;methane;4-methoxy-2-propan-2-yl-3H-isoindol-1-one;7-methoxy-2-propan-2-yl-3H-isoindol-1-one;3-methoxy-1-propan-2-yl-2H-pyrrol-5-one;tris(5-methyl-2-propan-2-yl-3H-isoindol-1-one);6-methyl-2-propan-2-yl-3H-isoindol-1-one;1-oxo-2-propan-2-yl-3H-isoindole-4-carbonitrile;3-oxo-2-propan-2-yl-1H-isoindole-4-carbonitrile.
What is the SMILES notation for 4-bromo-2-propan-2-yl-3H-isoindol-1-one;7-bromo-2-propan-2-yl-3H-isoindol-1-one;5-butyl-2-propan-2-yl-3H-isoindol-1-one;5-but-1-ynyl-2-propan-2-yl-3H-isoindol-1-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;7-chloro-2-propan-2-yl-3H-isoindol-1-one;4-fluoro-2-propan-2-yl-3H-isoindol-1-one;methane;4-methoxy-2-propan-2-yl-3H-isoindol-1-one;7-methoxy-2-propan-2-yl-3H-isoindol-1-one;3-methoxy-1-propan-2-yl-2H-pyrrol-5-one;tris(5-methyl-2-propan-2-yl-3H-isoindol-1-one);6-methyl-2-propan-2-yl-3H-isoindol-1-one;1-oxo-2-propan-2-yl-3H-isoindole-4-carbonitrile;3-oxo-2-propan-2-yl-1H-isoindole-4-carbonitrile?
The canonical SMILES for 4-bromo-2-propan-2-yl-3H-isoindol-1-one;7-bromo-2-propan-2-yl-3H-isoindol-1-one;5-butyl-2-propan-2-yl-3H-isoindol-1-one;5-but-1-ynyl-2-propan-2-yl-3H-isoindol-1-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;7-chloro-2-propan-2-yl-3H-isoindol-1-one;4-fluoro-2-propan-2-yl-3H-isoindol-1-one;methane;4-methoxy-2-propan-2-yl-3H-isoindol-1-one;7-methoxy-2-propan-2-yl-3H-isoindol-1-one;3-methoxy-1-propan-2-yl-2H-pyrrol-5-one;tris(5-methyl-2-propan-2-yl-3H-isoindol-1-one);6-methyl-2-propan-2-yl-3H-isoindol-1-one;1-oxo-2-propan-2-yl-3H-isoindole-4-carbonitrile;3-oxo-2-propan-2-yl-1H-isoindole-4-carbonitrile is C.C.C.C.C.CC(C)N1Cc2c(Br)cccc2C1=O.CC(C)N1Cc2c(C#N)cccc2C1=O.CC(C)N1Cc2c(Cl)cccc2C1=O.CC(C)N1Cc2c(F)cccc2C1=O.CC(C)N1Cc2cccc(Br)c2C1=O.CC(C)N1Cc2cccc(C#N)c2C1=O.CC(C)N1Cc2cccc(Cl)c2C1=O.CCC#Cc1ccc2c(c1)CN(C(C)C)C2=O.CCCCc1ccc2c(c1)CN(C(C)C)C2=O.COC1=CC(=O)N(C(C)C)C1.COc1cccc2c1C(=O)N(C(C)C)C2.COc1cccc2c1CN(C(C)C)C2=O.Cc1ccc2c(c1)C(=O)N(C(C)C)C2.Cc1ccc2c(c1)CN(C(C)C)C2=O.Cc1ccc2c(c1)CN(C(C)C)C2=O.Cc1ccc2c(c1)CN(C(C)C)C2=O.
What is the InChIKey of 4-bromo-2-propan-2-yl-3H-isoindol-1-one;7-bromo-2-propan-2-yl-3H-isoindol-1-one;5-butyl-2-propan-2-yl-3H-isoindol-1-one;5-but-1-ynyl-2-propan-2-yl-3H-isoindol-1-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;7-chloro-2-propan-2-yl-3H-isoindol-1-one;4-fluoro-2-propan-2-yl-3H-isoindol-1-one;methane;4-methoxy-2-propan-2-yl-3H-isoindol-1-one;7-methoxy-2-propan-2-yl-3H-isoindol-1-one;3-methoxy-1-propan-2-yl-2H-pyrrol-5-one;tris(5-methyl-2-propan-2-yl-3H-isoindol-1-one);6-methyl-2-propan-2-yl-3H-isoindol-1-one;1-oxo-2-propan-2-yl-3H-isoindole-4-carbonitrile;3-oxo-2-propan-2-yl-1H-isoindole-4-carbonitrile?
The InChIKey is BNDYVUNOJKTRDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO.C15H17NO.2C12H12N2O.2C12H15NO2.4C12H15NO.2C11H12BrNO.2C11H12ClNO.C11H12FNO.C8H13NO2.5CH4/c2*1-4-5-6-12-7-8-14-13(9-12)10-16(11(2)3)15(14)17;1-8(2)14-7-11-9(6-13)4-3-5-10(11)12(14)15;1-8(2)14-7-10-5-3-4-9(6-13)11(10)12(14)15;1-8(2)13-7-10-9(12(13)14)5-4-6-11(10)15-3;1-8(2)13-7-9-5-4-6-10(15-3)11(9)12(13)14;3*1-8(2)13-7-10-6-9(3)4-5-11(10)12(13)14;1-8(2)13-7-10-5-4-9(3)6-11(10)12(13)14;1-7(2)13-6-9-8(11(13)14)4-3-5-10(9)12;1-7(2)13-6-8-4-3-5-9(12)10(8)11(13)14;1-7(2)13-6-9-8(11(13)14)4-3-5-10(9)12;1-7(2)13-6-8-4-3-5-9(12)10(8)11(13)14;1-7(2)13-6-9-8(11(13)14)4-3-5-10(9)12;1-6(2)9-5-7(11-3)4-8(9)10;;;;;/h7-9,11H,4-6,10H2,1-3H3;7-9,11H,4,10H2,1-3H3;2*3-5,8H,7H2,1-2H3;2*4-6,8H,7H2,1-3H3;4*4-6,8H,7H2,1-3H3;5*3-5,7H,6H2,1-2H3;4,6H,5H2,1-3H3;5*1H4.
What are the key properties of 4-bromo-2-propan-2-yl-3H-isoindol-1-one;7-bromo-2-propan-2-yl-3H-isoindol-1-one;5-butyl-2-propan-2-yl-3H-isoindol-1-one;5-but-1-ynyl-2-propan-2-yl-3H-isoindol-1-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;7-chloro-2-propan-2-yl-3H-isoindol-1-one;4-fluoro-2-propan-2-yl-3H-isoindol-1-one;methane;4-methoxy-2-propan-2-yl-3H-isoindol-1-one;7-methoxy-2-propan-2-yl-3H-isoindol-1-one;3-methoxy-1-propan-2-yl-2H-pyrrol-5-one;tris(5-methyl-2-propan-2-yl-3H-isoindol-1-one);6-methyl-2-propan-2-yl-3H-isoindol-1-one;1-oxo-2-propan-2-yl-3H-isoindole-4-carbonitrile;3-oxo-2-propan-2-yl-1H-isoindole-4-carbonitrile?
4-bromo-2-propan-2-yl-3H-isoindol-1-one;7-bromo-2-propan-2-yl-3H-isoindol-1-one;5-butyl-2-propan-2-yl-3H-isoindol-1-one;5-but-1-ynyl-2-propan-2-yl-3H-isoindol-1-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;7-chloro-2-propan-2-yl-3H-isoindol-1-one;4-fluoro-2-propan-2-yl-3H-isoindol-1-one;methane;4-methoxy-2-propan-2-yl-3H-isoindol-1-one;7-methoxy-2-propan-2-yl-3H-isoindol-1-one;3-methoxy-1-propan-2-yl-2H-pyrrol-5-one;tris(5-methyl-2-propan-2-yl-3H-isoindol-1-one);6-methyl-2-propan-2-yl-3H-isoindol-1-one;1-oxo-2-propan-2-yl-3H-isoindole-4-carbonitrile;3-oxo-2-propan-2-yl-1H-isoindole-4-carbonitrile has a molecular weight of 3382.91 g/mol, XLogP of 40.78, 22 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-2-propan-2-yl-3H-isoindol-1-one;7-bromo-2-propan-2-yl-3H-isoindol-1-one;5-butyl-2-propan-2-yl-3H-isoindol-1-one;5-but-1-ynyl-2-propan-2-yl-3H-isoindol-1-one;4-chloro-2-propan-2-yl-3H-isoindol-1-one;7-chloro-2-propan-2-yl-3H-isoindol-1-one;4-fluoro-2-propan-2-yl-3H-isoindol-1-one;methane;4-methoxy-2-propan-2-yl-3H-isoindol-1-one;7-methoxy-2-propan-2-yl-3H-isoindol-1-one;3-methoxy-1-propan-2-yl-2H-pyrrol-5-one;tris(5-methyl-2-propan-2-yl-3H-isoindol-1-one);6-methyl-2-propan-2-yl-3H-isoindol-1-one;1-oxo-2-propan-2-yl-3H-isoindole-4-carbonitrile;3-oxo-2-propan-2-yl-1H-isoindole-4-carbonitrile is sourced from PubChem (CID 157401044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).