2-[2-(4-chlorophenyl)-3-[[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;4-[[2-(4-chlorophenyl)-6-methylimidazo[1,2-a]pyrazin-3-yl]methyl]morpholine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridazin-4-ylmethanone;N-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]acetamide;ethyl 2-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]acetate

C132H128Cl5N23O6 — CID 159753054

IUPAC2-[2-(4-chlorophenyl)-3-[[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;4-[[2-(4-chlorophenyl)-6-methylimidazo[1,2-a]pyrazin-3-yl]methyl]morpholine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridazin-4-ylmethanone;N-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]acetamide;ethyl 2-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]acetate
SMILESCC(=O)NC1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1.CCOC(=O)CN1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1.Cc1cn2c(CN3CCOCC3)c(-c3ccc(Cl)cc3)nc2cn1.N#Cc1ccccc1-c1ccc2nc(-c3ccc(Cl)cc3)c(CN3CCN(C(=O)C4CCC4)CC3)n2c1.O=C(c1ccnnc1)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1
InChIInChI=1S/C30H28ClN5O.C29H25ClN6O.C28H29ClN4O2.C27H27ClN4O.C18H19ClN4O/c31-25-11-8-21(9-12-25)29-27(20-34-14-16-35(17-15-34)30(37)22-5-3-6-22)36-19-24(10-13-28(36)33-29)26-7-2-1-4-23(26)18-32;30-25-9-6-22(7-10-25)28-26(36-19-24(8-11-27(36)33-28)21-4-2-1-3-5-21)20-34-14-16-35(17-15-34)29(37)23-12-13-31-32-18-23;1-2-35-27(34)20-32-16-14-31(15-17-32)19-25-28(22-8-11-24(29)12-9-22)30-26-13-10-23(18-33(25)26)21-6-4-3-5-7-21;1-19(33)29-24-13-15-31(16-14-24)18-25-27(21-7-10-23(28)11-8-21)30-26-12-9-22(17-32(25)26)20-5-3-2-4-6-20;1-13-11-23-16(12-22-6-8-24-9-7-22)18(21-17(23)10-20-13)14-2-4-15(19)5-3-14/h1-2,4,7-13,19,22H,3,5-6,14-17,20H2;1-13,18-19H,14-17,20H2;3-13,18H,2,14-17,19-20H2,1H3;2-12,17,24H,13-16,18H2,1H3,(H,29,33);2-5,10-11H,6-9,12H2,1H3
InChIKeyNDWYMXOVMDUQNT-UHFFFAOYSA-N
MW2309.90 g/mol
LogP24.32
Rot. Bonds25

About 2-[2-(4-chlorophenyl)-3-[[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;4-[[2-(4-chlorophenyl)-6-methylimidazo[1,2-a]pyrazin-3-yl]methyl]morpholine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridazin-4-ylmethanone;N-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]acetamide;ethyl 2-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]acetate

2-[2-(4-chlorophenyl)-3-[[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;4-[[2-(4-chlorophenyl)-6-methylimidazo[1,2-a]pyrazin-3-yl]methyl]morpholine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridazin-4-ylmethanone;N-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]acetamide;ethyl 2-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]acetate (PubChem CID 159753054) has the molecular formula C132H128Cl5N23O6 and a molecular weight of 2309.90 g/mol. Its IUPAC name is 2-[2-(4-chlorophenyl)-3-[[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;4-[[2-(4-chlorophenyl)-6-methylimidazo[1,2-a]pyrazin-3-yl]methyl]morpholine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridazin-4-ylmethanone;N-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]acetamide;ethyl 2-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]acetate.

Molecular Properties

Compound Name2-[2-(4-chlorophenyl)-3-[[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;4-[[2-(4-chlorophenyl)-6-methylimidazo[1,2-a]pyrazin-3-yl]methyl]morpholine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridazin-4-ylmethanone;N-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]acetamide;ethyl 2-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]acetate
PubChem CID159753054
Molecular FormulaC132H128Cl5N23O6
Molecular Weight2309.90 g/mol
Exact Mass2305.89
IUPAC Name2-[2-(4-chlorophenyl)-3-[[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;4-[[2-(4-chlorophenyl)-6-methylimidazo[1,2-a]pyrazin-3-yl]methyl]morpholine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridazin-4-ylmethanone;N-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]acetamide;ethyl 2-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]acetate
SMILESCC(=O)NC1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1.CCOC(=O)CN1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1.Cc1cn2c(CN3CCOCC3)c(-c3ccc(Cl)cc3)nc2cn1.N#Cc1ccccc1-c1ccc2nc(-c3ccc(Cl)cc3)c(CN3CCN(C(=O)C4CCC4)CC3)n2c1.O=C(c1ccnnc1)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1
InChIInChI=1S/C30H28ClN5O.C29H25ClN6O.C28H29ClN4O2.C27H27ClN4O.C18H19ClN4O/c31-25-11-8-21(9-12-25)29-27(20-34-14-16-35(17-15-34)30(37)22-5-3-6-22)36-19-24(10-13-28(36)33-29)26-7-2-1-4-23(26)18-32;30-25-9-6-22(7-10-25)28-26(36-19-24(8-11-27(36)33-28)21-4-2-1-3-5-21)20-34-14-16-35(17-15-34)29(37)23-12-13-31-32-18-23;1-2-35-27(34)20-32-16-14-31(15-17-32)19-25-28(22-8-11-24(29)12-9-22)30-26-13-10-23(18-33(25)26)21-6-4-3-5-7-21;1-19(33)29-24-13-15-31(16-14-24)18-25-27(21-7-10-23(28)11-8-21)30-26-12-9-22(17-32(25)26)20-5-3-2-4-6-20;1-13-11-23-16(12-22-6-8-24-9-7-22)18(21-17(23)10-20-13)14-2-4-15(19)5-3-14/h1-2,4,7-13,19,22H,3,5-6,14-17,20H2;1-13,18-19H,14-17,20H2;3-13,18H,2,14-17,19-20H2,1H3;2-12,17,24H,13-16,18H2,1H3,(H,29,33);2-5,10-11H,6-9,12H2,1H3
InChIKeyNDWYMXOVMDUQNT-UHFFFAOYSA-N
XLogP24.32
TPSA273.65 Ų
H-Bond Donors1
H-Bond Acceptors26
Rotatable Bonds25
Heavy Atoms166
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002309.90
LogP ≤ 524.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1026

Analyze 2-[2-(4-chlorophenyl)-3-[[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;4-[[2-(4-chlorophenyl)-6-methylimidazo[1,2-a]pyrazin-3-yl]methyl]morpholine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridazin-4-ylmethanone;N-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]acetamide;ethyl 2-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]acetate with MolForge

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Related Compounds

[7-(aminomethyl)-6-(2,4-dichlorophenyl)imidazo[1,2-a]pyridin-3-yl]-[3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl]methanone;7-(aminomethyl)-6-(2,4-dichlorophenyl)-N-(2-methoxyethyl)-N-methylimidazo[1,2-a]pyridine-3-carboxamide;7-(aminomethyl)-6-(2,4-dichlorophenyl)-N-pyridin-3-ylimidazo[1,2-a]pyridine-3-carboxamide;7-(aminomethyl)-6-(2,4-dichlorophenyl)-N-pyridin-4-ylimidazo[1,2-a]pyridine-3-carboxamide
CID 157225219
N-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methyl]-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide;N-(3-chloro-5-methyl-2-pyridinyl)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide;N-(2-cyclopentylpyrazol-3-yl)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetamide;N-cyclopropyl-2-[[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetyl]amino]benzamide;2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]acetamide
CID 123975768
4-chloro-N-(4-chlorophenyl)-3-methyl-1-[2-(oxan-4-ylamino)ethyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-(3-pyrrolidin-1-ylpropyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[2-(oxan-4-ylamino)ethyl]pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-(3-pyrrolidin-1-ylpropyl)pyrrolo[2,3-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-(2-morpholin-4-ylethyl)-N-(4-propan-2-ylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide
CID 157098742
4-[[2-(4-chlorophenyl)-6-(2,6-difluorophenyl)imidazo[1,2-a]pyrazin-3-yl]methyl]morpholine;[4-[[2-(4-chlorophenyl)-6-(2,6-difluorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-4-ylmethanone;2-[2-(4-chlorophenyl)-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyridin-6-yl]-3-fluorobenzonitrile;4-[[2-(4-chlorophenyl)-6-(oxan-4-yl)imidazo[1,2-a]pyridin-3-yl]methyl]morpholine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(1H-imidazol-2-yl)methanone
CID 157101962
[4-[[2-(4-Chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyrazin-3-yl]methyl]piperazin-1-yl]-pyridin-4-ylmethanone;[4-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxan-4-yl)methanone;[4-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyrazin-2-ylmethanone;[4-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridazin-4-ylmethanone
CID 157158717
4-[8-Tert-butyl-6-(4-fluorophenyl)imidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylmorpholin-2-one;4-[6-(3-chloro-4-methylphenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-2-one;4-[6-(4-chloro-3-methylphenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylpiperazin-2-one;4-[6-(4-fluorophenyl)-8-propan-2-ylimidazo[1,2-b]pyridazine-2-carbonyl]-3,3-dimethylmorpholin-2-one;methyl 2-[1-[8-tert-butyl-6-(4-fluorophenyl)imidazo[1,2-b]pyridazine-2-carbonyl]-2-methyl-3-oxopiperazin-2-yl]acetate
CID 157210490
2-[3-[(4-acetylpiperazin-1-yl)methyl]-2-(4-chlorophenyl)imidazo[1,2-a]pyrazin-6-yl]benzonitrile;1-[4-[[2-(4-chlorophenyl)-6-(2,6-difluorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;1-[4-[[2-(4-chlorophenyl)-6-(2,6-difluorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methoxyethanone;1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]-1,4-diazepan-5-one;2-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl-methylamino]-N,N-dimethylacetamide
CID 157214402
4-[[2-(4-Chloro-2-fluorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;2-[2-(4-chlorophenyl)-3-[(4-methyl-3-oxopiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]-1-methylpiperazin-2-one;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(1-methylimidazol-2-yl)methanone
CID 157258349
6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]imidazo[1,2-a]pyridine-3-carboxamide;7-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;7-[2-(3-methylphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 157292515
[4-[[6-(2-chlorophenyl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-cyclobutylmethanone;2-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methylamino]-N,N-dimethylacetamide;7-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]-3-methyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(oxan-4-yl)methanone;1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-amine
CID 157428109
[4-[[2-(4-Chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyrazin-3-yl]methyl]piperazin-1-yl]-pyridazin-4-ylmethanone;[4-[[2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyrazin-3-yl]methyl]piperazin-1-yl]-(1,3-thiazol-4-yl)methanone;2-[2-(4-chlorophenyl)-3-(morpholin-4-ylmethyl)imidazo[1,2-a]pyrazin-6-yl]benzonitrile;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-(1,3-thiazol-2-yl)methanone
CID 157439796
4-chloro-N-(4-chlorophenyl)-1-[(1-ethylimidazol-2-yl)methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-1-[[1-(2-methoxyethyl)imidazol-2-yl]methyl]-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-propan-2-ylimidazol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-1-[(1-ethylimidazol-2-yl)methyl]-3-methyl-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-1-[(1-methylimidazol-2-yl)methyl]-N-(4-methylphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide;4-chloro-3-methyl-N-(4-methylphenyl)-1-[(1-propan-2-ylimidazol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide
CID 157441068

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-chlorophenyl)-3-[[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;4-[[2-(4-chlorophenyl)-6-methylimidazo[1,2-a]pyrazin-3-yl]methyl]morpholine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridazin-4-ylmethanone;N-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]acetamide;ethyl 2-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]acetate?
The IUPAC name of 2-[2-(4-chlorophenyl)-3-[[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;4-[[2-(4-chlorophenyl)-6-methylimidazo[1,2-a]pyrazin-3-yl]methyl]morpholine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridazin-4-ylmethanone;N-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]acetamide;ethyl 2-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]acetate (CID 159753054) is 2-[2-(4-chlorophenyl)-3-[[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;4-[[2-(4-chlorophenyl)-6-methylimidazo[1,2-a]pyrazin-3-yl]methyl]morpholine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridazin-4-ylmethanone;N-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]acetamide;ethyl 2-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]acetate.
What is the SMILES notation for 2-[2-(4-chlorophenyl)-3-[[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;4-[[2-(4-chlorophenyl)-6-methylimidazo[1,2-a]pyrazin-3-yl]methyl]morpholine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridazin-4-ylmethanone;N-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]acetamide;ethyl 2-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]acetate?
The canonical SMILES for 2-[2-(4-chlorophenyl)-3-[[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;4-[[2-(4-chlorophenyl)-6-methylimidazo[1,2-a]pyrazin-3-yl]methyl]morpholine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridazin-4-ylmethanone;N-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]acetamide;ethyl 2-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]acetate is CC(=O)NC1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1.CCOC(=O)CN1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1.Cc1cn2c(CN3CCOCC3)c(-c3ccc(Cl)cc3)nc2cn1.N#Cc1ccccc1-c1ccc2nc(-c3ccc(Cl)cc3)c(CN3CCN(C(=O)C4CCC4)CC3)n2c1.O=C(c1ccnnc1)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1.
What is the InChIKey of 2-[2-(4-chlorophenyl)-3-[[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;4-[[2-(4-chlorophenyl)-6-methylimidazo[1,2-a]pyrazin-3-yl]methyl]morpholine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridazin-4-ylmethanone;N-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]acetamide;ethyl 2-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]acetate?
The InChIKey is NDWYMXOVMDUQNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H28ClN5O.C29H25ClN6O.C28H29ClN4O2.C27H27ClN4O.C18H19ClN4O/c31-25-11-8-21(9-12-25)29-27(20-34-14-16-35(17-15-34)30(37)22-5-3-6-22)36-19-24(10-13-28(36)33-29)26-7-2-1-4-23(26)18-32;30-25-9-6-22(7-10-25)28-26(36-19-24(8-11-27(36)33-28)21-4-2-1-3-5-21)20-34-14-16-35(17-15-34)29(37)23-12-13-31-32-18-23;1-2-35-27(34)20-32-16-14-31(15-17-32)19-25-28(22-8-11-24(29)12-9-22)30-26-13-10-23(18-33(25)26)21-6-4-3-5-7-21;1-19(33)29-24-13-15-31(16-14-24)18-25-27(21-7-10-23(28)11-8-21)30-26-12-9-22(17-32(25)26)20-5-3-2-4-6-20;1-13-11-23-16(12-22-6-8-24-9-7-22)18(21-17(23)10-20-13)14-2-4-15(19)5-3-14/h1-2,4,7-13,19,22H,3,5-6,14-17,20H2;1-13,18-19H,14-17,20H2;3-13,18H,2,14-17,19-20H2,1H3;2-12,17,24H,13-16,18H2,1H3,(H,29,33);2-5,10-11H,6-9,12H2,1H3.
What are the key properties of 2-[2-(4-chlorophenyl)-3-[[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;4-[[2-(4-chlorophenyl)-6-methylimidazo[1,2-a]pyrazin-3-yl]methyl]morpholine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridazin-4-ylmethanone;N-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]acetamide;ethyl 2-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]acetate?
2-[2-(4-chlorophenyl)-3-[[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;4-[[2-(4-chlorophenyl)-6-methylimidazo[1,2-a]pyrazin-3-yl]methyl]morpholine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridazin-4-ylmethanone;N-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]acetamide;ethyl 2-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]acetate has a molecular weight of 2309.90 g/mol, XLogP of 24.32, 25 rotatable bonds, 1 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-chlorophenyl)-3-[[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;4-[[2-(4-chlorophenyl)-6-methylimidazo[1,2-a]pyrazin-3-yl]methyl]morpholine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridazin-4-ylmethanone;N-[1-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperidin-4-yl]acetamide;ethyl 2-[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]acetate is sourced from PubChem (CID 159753054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).