N-[5-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]-2-(morpholine-4-carbonyl)phenyl]acetamide;methyl 2-acetamido-4-bromobenzoate;bis(methyl 2-acetamido-4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate);methyl 2-acetamido-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate;methyl 2-amino-4-bromobenzoate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane

C121H123B3Br2N16O23 — CID 159519703

IUPACN-[5-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]-2-(morpholine-4-carbonyl)phenyl]acetamide;methyl 2-acetamido-4-bromobenzoate;bis(methyl 2-acetamido-4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate);methyl 2-acetamido-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate;methyl 2-amino-4-bromobenzoate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane
SMILESCC(=O)Nc1cc(-c2ccc3ncc(-c4ccc(C#N)cc4)n3c2)ccc1C(=O)N1CCOCC1.CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.COC(=O)c1ccc(-c2ccc3ncc(-c4ccc(C#N)cc4)n3c2)cc1NC(C)=O.COC(=O)c1ccc(-c2ccc3ncc(-c4ccc(C#N)cc4)n3c2)cc1NC(C)=O.COC(=O)c1ccc(B2OC(C)(C)C(C)(C)O2)cc1NC(C)=O.COC(=O)c1ccc(Br)cc1N.COC(=O)c1ccc(Br)cc1NC(C)=O
InChIInChI=1S/C27H23N5O3.2C24H18N4O3.C16H22BNO5.C12H24B2O4.C10H10BrNO3.C8H8BrNO2/c1-18(33)30-24-14-21(6-8-23(24)27(34)31-10-12-35-13-11-31)22-7-9-26-29-16-25(32(26)17-22)20-4-2-19(15-28)3-5-20;2*1-15(29)27-21-11-18(7-9-20(21)24(30)31-2)19-8-10-23-26-13-22(28(23)14-19)17-5-3-16(12-25)4-6-17;1-10(19)18-13-9-11(7-8-12(13)14(20)21-6)17-22-15(2,3)16(4,5)23-17;1-9(2)10(3,4)16-13(15-9)14-17-11(5,6)12(7,8)18-14;1-6(13)12-9-5-7(11)3-4-8(9)10(14)15-2;1-12-8(11)6-3-2-5(9)4-7(6)10/h2-9,14,16-17H,10-13H2,1H3,(H,30,33);2*3-11,13-14H,1-2H3,(H,27,29);7-9H,1-6H3,(H,18,19);1-8H3;3-5H,1-2H3,(H,12,13);2-4H,10H2,1H3
InChIKeyMBQNBLVCXYZZMQ-UHFFFAOYSA-N
MW2361.65 g/mol
LogP20.53
Rot. Bonds19

About N-[5-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]-2-(morpholine-4-carbonyl)phenyl]acetamide;methyl 2-acetamido-4-bromobenzoate;bis(methyl 2-acetamido-4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate);methyl 2-acetamido-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate;methyl 2-amino-4-bromobenzoate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane

N-[5-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]-2-(morpholine-4-carbonyl)phenyl]acetamide;methyl 2-acetamido-4-bromobenzoate;bis(methyl 2-acetamido-4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate);methyl 2-acetamido-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate;methyl 2-amino-4-bromobenzoate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane (PubChem CID 159519703) has the molecular formula C121H123B3Br2N16O23 and a molecular weight of 2361.65 g/mol. Its IUPAC name is N-[5-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]-2-(morpholine-4-carbonyl)phenyl]acetamide;methyl 2-acetamido-4-bromobenzoate;bis(methyl 2-acetamido-4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate);methyl 2-acetamido-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate;methyl 2-amino-4-bromobenzoate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane.

Molecular Properties

Compound NameN-[5-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]-2-(morpholine-4-carbonyl)phenyl]acetamide;methyl 2-acetamido-4-bromobenzoate;bis(methyl 2-acetamido-4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate);methyl 2-acetamido-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate;methyl 2-amino-4-bromobenzoate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane
PubChem CID159519703
Molecular FormulaC121H123B3Br2N16O23
Molecular Weight2361.65 g/mol
Exact Mass2358.76
IUPAC NameN-[5-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]-2-(morpholine-4-carbonyl)phenyl]acetamide;methyl 2-acetamido-4-bromobenzoate;bis(methyl 2-acetamido-4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate);methyl 2-acetamido-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate;methyl 2-amino-4-bromobenzoate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane
SMILESCC(=O)Nc1cc(-c2ccc3ncc(-c4ccc(C#N)cc4)n3c2)ccc1C(=O)N1CCOCC1.CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.COC(=O)c1ccc(-c2ccc3ncc(-c4ccc(C#N)cc4)n3c2)cc1NC(C)=O.COC(=O)c1ccc(-c2ccc3ncc(-c4ccc(C#N)cc4)n3c2)cc1NC(C)=O.COC(=O)c1ccc(B2OC(C)(C)C(C)(C)O2)cc1NC(C)=O.COC(=O)c1ccc(Br)cc1N.COC(=O)c1ccc(Br)cc1NC(C)=O
InChIInChI=1S/C27H23N5O3.2C24H18N4O3.C16H22BNO5.C12H24B2O4.C10H10BrNO3.C8H8BrNO2/c1-18(33)30-24-14-21(6-8-23(24)27(34)31-10-12-35-13-11-31)22-7-9-26-29-16-25(32(26)17-22)20-4-2-19(15-28)3-5-20;2*1-15(29)27-21-11-18(7-9-20(21)24(30)31-2)19-8-10-23-26-13-22(28(23)14-19)17-5-3-16(12-25)4-6-17;1-10(19)18-13-9-11(7-8-12(13)14(20)21-6)17-22-15(2,3)16(4,5)23-17;1-9(2)10(3,4)16-13(15-9)14-17-11(5,6)12(7,8)18-14;1-6(13)12-9-5-7(11)3-4-8(9)10(14)15-2;1-12-8(11)6-3-2-5(9)4-7(6)10/h2-9,14,16-17H,10-13H2,1H3,(H,30,33);2*3-11,13-14H,1-2H3,(H,27,29);7-9H,1-6H3,(H,18,19);1-8H3;3-5H,1-2H3,(H,12,13);2-4H,10H2,1H3
InChIKeyMBQNBLVCXYZZMQ-UHFFFAOYSA-N
XLogP20.53
TPSA511.21 Ų
H-Bond Donors6
H-Bond Acceptors33
Rotatable Bonds19
Heavy Atoms165
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002361.65
LogP ≤ 520.53
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1033

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze N-[5-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]-2-(morpholine-4-carbonyl)phenyl]acetamide;methyl 2-acetamido-4-bromobenzoate;bis(methyl 2-acetamido-4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate);methyl 2-acetamido-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate;methyl 2-amino-4-bromobenzoate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane with MolForge

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Related Compounds

Lithium;6-bromoimidazo[1,2-a]pyridine;4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]-2-fluorobenzoic acid;(4-ethoxycarbonyl-3-fluorophenyl)boronic acid;ethyl 4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]-2-fluorobenzoate;ethyl 2-fluoro-4-imidazo[1,2-a]pyridin-6-ylbenzoate;ethyl 2-fluoro-4-(3-iodoimidazo[1,2-a]pyridin-6-yl)benzoate;4-[6-[3-fluoro-4-(4-methylpiperazine-1-carbonyl)phenyl]imidazo[1,2-a]pyridin-3-yl]benzonitrile;(4-isocyanophenyl)boronic acid;1-methylpiperidine;hydroxide
CID 157390537
6-bromo-4H-isochromene-1,3-dione;tert-butyl N-[1-(2-acetamidobenzoyl)piperidin-4-yl]-N-methylcarbamate;tert-butyl N-[1-(2-acetamido-4-bromobenzoyl)piperidin-4-yl]-N-methylcarbamate;tert-butyl N-[1-[2-acetamido-4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]benzoyl]piperidin-4-yl]-N-methylcarbamate;tert-butyl N-cyclohexyl-N-methylcarbamate;N-[5-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]-2-[4-(methylamino)piperidine-1-carbonyl]phenyl]acetamide;4-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridin-3-yl]benzonitrile
CID 157545996
(4-acetylphenyl)boronic acid;6-bromo-3-iodo-7-methylimidazo[1,2-a]pyridine;6-bromo-7-methylimidazo[1,2-a]pyridine;4-(6-bromo-7-methylimidazo[1,2-a]pyridin-3-yl)benzonitrile;5-bromo-4-methylpyridin-2-amine;tert-butyl N-[1-[4-[3-(4-cyanophenyl)-7-methylimidazo[1,2-a]pyridin-6-yl]benzoyl]-4-methylpiperidin-4-yl]carbamate;2-chloroacetaldehyde;4-[3-(4-cyanophenyl)-7-methylimidazo[1,2-a]pyridin-6-yl]benzoic acid;4,4-dimethylpiperidine;ethyl 4-[3-(4-cyanophenyl)-7-methylimidazo[1,2-a]pyridin-6-yl]benzoate;(4-isocyanophenyl)boronic acid
CID 157672351
6-bromo-N-tert-butylimidazo[1,2-a]pyridin-8-amine;2-bromo-6-(6-tert-butyl-1-oxoisoquinolin-2-yl)benzaldehyde;[2-bromo-6-(6-tert-butyl-1-oxoisoquinolin-2-yl)phenyl]methyl acetate;6-bromo-3,4-dihydro-2H-isoquinolin-1-one;2-[3-bromo-2-(hydroxymethyl)phenyl]-6-tert-butylisoquinolin-1-one;[2-[8-(tert-butylamino)imidazo[1,2-a]pyridin-6-yl]-6-(6-tert-butyl-1-oxoisoquinolin-2-yl)phenyl]methyl acetate;6-tert-butyl-2-[3-[8-(tert-butylamino)imidazo[1,2-a]pyridin-6-yl]-2-(hydroxymethyl)phenyl]isoquinolin-1-one;6-tert-butyl-2H-isoquinolin-1-one;[2-(6-tert-butyl-1-oxoisoquinolin-2-yl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl acetate;2,6-dibromobenzaldehyde
CID 158263338
Tert-butyl 4-(4-bromo-2-piperidin-1-ylbenzoyl)piperazine-1-carboxylate;tert-butyl 4-[4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]-2-piperidin-1-ylbenzoyl]piperazine-1-carboxylate;4-[6-[4-(piperazine-1-carbonyl)-3-piperazin-1-ylphenyl]imidazo[1,2-a]pyridin-3-yl]benzonitrile;4-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridin-3-yl]benzonitrile
CID 158726292
6-bromo-4H-isochromene-1,3-dione;tert-butyl 4-(2-acetamido-4-bromobenzoyl)piperazine-1-carboxylate;tert-butyl 4-[2-acetamido-4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]benzoyl]piperazine-1-carboxylate;tert-butyl 4-(2-amino-4-bromobenzoyl)piperazine-1-carboxylate;tert-butyl piperidine-1-carboxylate;N-[5-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]-2-(piperazine-1-carbonyl)phenyl]acetamide;4-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridin-3-yl]benzonitrile
CID 159160219
6-bromo-4H-isochromene-1,3-dione;tert-butyl N-[1-(2-acetamido-4-bromobenzoyl)piperidin-4-yl]-N-methylcarbamate;tert-butyl N-[1-[2-acetamido-4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]benzoyl]piperidin-4-yl]-N-methylcarbamate;tert-butyl N-[1-(2-amino-4-bromobenzoyl)piperidin-4-yl]-N-methylcarbamate;tert-butyl N-cyclohexyl-N-methylcarbamate;N-[5-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]-2-[4-(methylamino)piperidine-1-carbonyl]phenyl]acetamide;4-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridin-3-yl]benzonitrile
CID 159201135
benzyl (2S)-2-(8-amino-1-bromoimidazo[1,5-a]pyrazin-3-yl)pyrrolidine-1-carboxylate;benzyl (2S)-2-[8-amino-1-[4-(pyridin-2-ylcarbamoyl)phenyl]imidazo[1,5-a]pyrazin-3-yl]pyrrolidine-1-carboxylate;methane;N-pyridin-2-yl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide
CID 159831089
Tert-butyl 4-(4-bromo-2-cyclohexylbenzoyl)piperazine-1-carboxylate;tert-butyl 4-[4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]-2-piperidin-1-ylbenzoyl]piperazine-1-carboxylate;4-[6-[4-(piperazine-1-carbonyl)-3-piperazin-1-ylphenyl]imidazo[1,2-a]pyridin-3-yl]benzonitrile;4-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridin-3-yl]benzonitrile
CID 159850698
4-Bromo-2-fluorobenzoic acid;4-bromo-2-morpholin-4-ylbenzoic acid;(4-bromo-2-morpholin-4-ylphenyl)-morpholin-4-ylmethanone;4-[6-[4-(morpholine-4-carbonyl)-3-morpholin-4-ylphenyl]imidazo[1,2-a]pyridin-3-yl]benzonitrile;oxane;4-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridin-3-yl]benzonitrile
CID 159984082
(4-bromophenyl)-cyclohexylmethanone;tert-butyl 4-[4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]benzoyl]piperidine-1-carboxylate;4-[6-[4-[hydroxy(piperidin-4-yl)methyl]phenyl]imidazo[1,2-a]pyridin-3-yl]benzonitrile;4-[6-[4-[(S)-hydroxy(piperidin-4-yl)methyl]phenyl]imidazo[1,2-a]pyridin-3-yl]benzonitrile;4-[6-[4-(piperidine-4-carbonyl)phenyl]imidazo[1,2-a]pyridin-3-yl]benzonitrile;4-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridin-3-yl]benzonitrile
CID 160001530
(4-bromophenyl)-cyclohexylmethanone;tert-butyl 4-[4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]benzoyl]piperidine-1-carboxylate;4-[6-[4-[hydroxy(piperidin-4-yl)methyl]phenyl]imidazo[1,2-a]pyridin-3-yl]benzonitrile;4-[6-[4-[(R)-hydroxy(piperidin-4-yl)methyl]phenyl]imidazo[1,2-a]pyridin-3-yl]benzonitrile;4-[6-[4-[(S)-hydroxy(piperidin-4-yl)methyl]phenyl]imidazo[1,2-a]pyridin-3-yl]benzonitrile;4-[6-[4-(piperidine-4-carbonyl)phenyl]imidazo[1,2-a]pyridin-3-yl]benzonitrile;4-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridin-3-yl]benzonitrile
CID 160067928

Frequently Asked Questions

What is the IUPAC name of N-[5-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]-2-(morpholine-4-carbonyl)phenyl]acetamide;methyl 2-acetamido-4-bromobenzoate;bis(methyl 2-acetamido-4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate);methyl 2-acetamido-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate;methyl 2-amino-4-bromobenzoate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?
The IUPAC name of N-[5-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]-2-(morpholine-4-carbonyl)phenyl]acetamide;methyl 2-acetamido-4-bromobenzoate;bis(methyl 2-acetamido-4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate);methyl 2-acetamido-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate;methyl 2-amino-4-bromobenzoate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane (CID 159519703) is N-[5-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]-2-(morpholine-4-carbonyl)phenyl]acetamide;methyl 2-acetamido-4-bromobenzoate;bis(methyl 2-acetamido-4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate);methyl 2-acetamido-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate;methyl 2-amino-4-bromobenzoate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane.
What is the SMILES notation for N-[5-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]-2-(morpholine-4-carbonyl)phenyl]acetamide;methyl 2-acetamido-4-bromobenzoate;bis(methyl 2-acetamido-4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate);methyl 2-acetamido-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate;methyl 2-amino-4-bromobenzoate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?
The canonical SMILES for N-[5-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]-2-(morpholine-4-carbonyl)phenyl]acetamide;methyl 2-acetamido-4-bromobenzoate;bis(methyl 2-acetamido-4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate);methyl 2-acetamido-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate;methyl 2-amino-4-bromobenzoate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane is CC(=O)Nc1cc(-c2ccc3ncc(-c4ccc(C#N)cc4)n3c2)ccc1C(=O)N1CCOCC1.CC1(C)OB(B2OC(C)(C)C(C)(C)O2)OC1(C)C.COC(=O)c1ccc(-c2ccc3ncc(-c4ccc(C#N)cc4)n3c2)cc1NC(C)=O.COC(=O)c1ccc(-c2ccc3ncc(-c4ccc(C#N)cc4)n3c2)cc1NC(C)=O.COC(=O)c1ccc(B2OC(C)(C)C(C)(C)O2)cc1NC(C)=O.COC(=O)c1ccc(Br)cc1N.COC(=O)c1ccc(Br)cc1NC(C)=O.
What is the InChIKey of N-[5-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]-2-(morpholine-4-carbonyl)phenyl]acetamide;methyl 2-acetamido-4-bromobenzoate;bis(methyl 2-acetamido-4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate);methyl 2-acetamido-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate;methyl 2-amino-4-bromobenzoate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?
The InChIKey is MBQNBLVCXYZZMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H23N5O3.2C24H18N4O3.C16H22BNO5.C12H24B2O4.C10H10BrNO3.C8H8BrNO2/c1-18(33)30-24-14-21(6-8-23(24)27(34)31-10-12-35-13-11-31)22-7-9-26-29-16-25(32(26)17-22)20-4-2-19(15-28)3-5-20;2*1-15(29)27-21-11-18(7-9-20(21)24(30)31-2)19-8-10-23-26-13-22(28(23)14-19)17-5-3-16(12-25)4-6-17;1-10(19)18-13-9-11(7-8-12(13)14(20)21-6)17-22-15(2,3)16(4,5)23-17;1-9(2)10(3,4)16-13(15-9)14-17-11(5,6)12(7,8)18-14;1-6(13)12-9-5-7(11)3-4-8(9)10(14)15-2;1-12-8(11)6-3-2-5(9)4-7(6)10/h2-9,14,16-17H,10-13H2,1H3,(H,30,33);2*3-11,13-14H,1-2H3,(H,27,29);7-9H,1-6H3,(H,18,19);1-8H3;3-5H,1-2H3,(H,12,13);2-4H,10H2,1H3.
What are the key properties of N-[5-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]-2-(morpholine-4-carbonyl)phenyl]acetamide;methyl 2-acetamido-4-bromobenzoate;bis(methyl 2-acetamido-4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate);methyl 2-acetamido-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate;methyl 2-amino-4-bromobenzoate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane?
N-[5-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]-2-(morpholine-4-carbonyl)phenyl]acetamide;methyl 2-acetamido-4-bromobenzoate;bis(methyl 2-acetamido-4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate);methyl 2-acetamido-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate;methyl 2-amino-4-bromobenzoate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane has a molecular weight of 2361.65 g/mol, XLogP of 20.53, 19 rotatable bonds, 6 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]-2-(morpholine-4-carbonyl)phenyl]acetamide;methyl 2-acetamido-4-bromobenzoate;bis(methyl 2-acetamido-4-[3-(4-cyanophenyl)imidazo[1,2-a]pyridin-6-yl]benzoate);methyl 2-acetamido-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate;methyl 2-amino-4-bromobenzoate;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane is sourced from PubChem (CID 159519703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).