6-chloro-N-ethyl-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-N-(3-hydroxycyclobutyl)-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(2-methylpropyl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(oxetan-3-yl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-propan-2-ylimidazo[1,2-b]pyridazine-3-carboxamide

C96H108Cl5N25O12 — CID 161469266

IUPAC6-chloro-N-ethyl-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-N-(3-hydroxycyclobutyl)-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(2-methylpropyl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(oxetan-3-yl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-propan-2-ylimidazo[1,2-b]pyridazine-3-carboxamide
SMILESCCNC(=O)c1cnc2c(N(C)Cc3ccc(OC)cc3)cc(Cl)nn12.COc1ccc(CN(C)c2cc(Cl)nn3c(C(=O)NC(C)C)cnc23)cc1.COc1ccc(CN(C)c2cc(Cl)nn3c(C(=O)NC4CC(O)C4)cnc23)cc1.COc1ccc(CN(C)c2cc(Cl)nn3c(C(=O)NC4COC4)cnc23)cc1.COc1ccc(CN(C)c2cc(Cl)nn3c(C(=O)NCC(C)C)cnc23)cc1
InChIInChI=1S/C20H22ClN5O3.C20H24ClN5O2.C19H20ClN5O3.C19H22ClN5O2.C18H20ClN5O2/c1-25(11-12-3-5-15(29-2)6-4-12)16-9-18(21)24-26-17(10-22-19(16)26)20(28)23-13-7-14(27)8-13;1-13(2)10-23-20(27)17-11-22-19-16(9-18(21)24-26(17)19)25(3)12-14-5-7-15(28-4)8-6-14;1-24(9-12-3-5-14(27-2)6-4-12)15-7-17(20)23-25-16(8-21-18(15)25)19(26)22-13-10-28-11-13;1-12(2)22-19(26)16-10-21-18-15(9-17(20)23-25(16)18)24(3)11-13-5-7-14(27-4)8-6-13;1-4-20-18(25)15-10-21-17-14(9-16(19)22-24(15)17)23(2)11-12-5-7-13(26-3)8-6-12/h3-6,9-10,13-14,27H,7-8,11H2,1-2H3,(H,23,28);5-9,11,13H,10,12H2,1-4H3,(H,23,27);3-8,13H,9-11H2,1-2H3,(H,22,26);5-10,12H,11H2,1-4H3,(H,22,26);5-10H,4,11H2,1-3H3,(H,20,25)
InChIKeyWCVWCZPQBZAIQN-UHFFFAOYSA-N
MW1981.35 g/mol
LogP13.79
Rot. Bonds31

About 6-chloro-N-ethyl-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-N-(3-hydroxycyclobutyl)-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(2-methylpropyl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(oxetan-3-yl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-propan-2-ylimidazo[1,2-b]pyridazine-3-carboxamide

6-chloro-N-ethyl-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-N-(3-hydroxycyclobutyl)-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(2-methylpropyl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(oxetan-3-yl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-propan-2-ylimidazo[1,2-b]pyridazine-3-carboxamide (PubChem CID 161469266) has the molecular formula C96H108Cl5N25O12 and a molecular weight of 1981.35 g/mol. Its IUPAC name is 6-chloro-N-ethyl-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-N-(3-hydroxycyclobutyl)-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(2-methylpropyl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(oxetan-3-yl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-propan-2-ylimidazo[1,2-b]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-ethyl-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-N-(3-hydroxycyclobutyl)-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(2-methylpropyl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(oxetan-3-yl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-propan-2-ylimidazo[1,2-b]pyridazine-3-carboxamide
PubChem CID161469266
Molecular FormulaC96H108Cl5N25O12
Molecular Weight1981.35 g/mol
Exact Mass1977.71
IUPAC Name6-chloro-N-ethyl-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-N-(3-hydroxycyclobutyl)-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(2-methylpropyl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(oxetan-3-yl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-propan-2-ylimidazo[1,2-b]pyridazine-3-carboxamide
SMILESCCNC(=O)c1cnc2c(N(C)Cc3ccc(OC)cc3)cc(Cl)nn12.COc1ccc(CN(C)c2cc(Cl)nn3c(C(=O)NC(C)C)cnc23)cc1.COc1ccc(CN(C)c2cc(Cl)nn3c(C(=O)NC4CC(O)C4)cnc23)cc1.COc1ccc(CN(C)c2cc(Cl)nn3c(C(=O)NC4COC4)cnc23)cc1.COc1ccc(CN(C)c2cc(Cl)nn3c(C(=O)NCC(C)C)cnc23)cc1
InChIInChI=1S/C20H22ClN5O3.C20H24ClN5O2.C19H20ClN5O3.C19H22ClN5O2.C18H20ClN5O2/c1-25(11-12-3-5-15(29-2)6-4-12)16-9-18(21)24-26-17(10-22-19(16)26)20(28)23-13-7-14(27)8-13;1-13(2)10-23-20(27)17-11-22-19-16(9-18(21)24-26(17)19)25(3)12-14-5-7-15(28-4)8-6-14;1-24(9-12-3-5-14(27-2)6-4-12)15-7-17(20)23-25-16(8-21-18(15)25)19(26)22-13-10-28-11-13;1-12(2)22-19(26)16-10-21-18-15(9-17(20)23-25(16)18)24(3)11-13-5-7-14(27-4)8-6-13;1-4-20-18(25)15-10-21-17-14(9-16(19)22-24(15)17)23(2)11-12-5-7-13(26-3)8-6-12/h3-6,9-10,13-14,27H,7-8,11H2,1-2H3,(H,23,28);5-9,11,13H,10,12H2,1-4H3,(H,23,27);3-8,13H,9-11H2,1-2H3,(H,22,26);5-10,12H,11H2,1-4H3,(H,22,26);5-10H,4,11H2,1-3H3,(H,20,25)
InChIKeyWCVWCZPQBZAIQN-UHFFFAOYSA-N
XLogP13.79
TPSA388.26 Ų
H-Bond Donors6
H-Bond Acceptors32
Rotatable Bonds31
Heavy Atoms138
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001981.35
LogP ≤ 513.79
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1032

Analyze 6-chloro-N-ethyl-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-N-(3-hydroxycyclobutyl)-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(2-methylpropyl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(oxetan-3-yl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-propan-2-ylimidazo[1,2-b]pyridazine-3-carboxamide with MolForge

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Related Compounds

3-amino-5-(trifluoromethyl)benzonitrile;6-[3-cyano-5-(trifluoromethyl)anilino]-8-(cyclopropylamino)imidazo[1,2-b]pyridazine-3-carboxylic acid;ethyl 6-chloro-8-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]imidazo[1,2-b]pyridazine-3-carboxylate;ethyl 6-[3-cyano-5-(trifluoromethyl)anilino]-8-(cyclopropylamino)imidazo[1,2-b]pyridazine-3-carboxylate;ethyl 6,8-dichloroimidazo[1,2-b]pyridazine-3-carboxylate;N-[(4-methoxyphenyl)methyl]cyclopropanamine
CID 157728120
8-chloro-3-(1,1-difluoroethyl)-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-(1,1-difluoroethyl)-7-fluoro-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-(1,1-difluoroethyl)-8-(methoxymethyl)-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-(1,1-difluoroethyl)-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazin-7-amine;3-(1,1-difluoroethyl)-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine-7-carboxamide;N-[3-(1,1-difluoroethyl)-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazin-7-yl]acetamide;[3-(1,1-difluoroethyl)-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazin-8-yl]methanol;6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-3-(4-methylphenoxy)-[1,2,4]triazolo[4,3-a]pyrazine
CID 157988270
6-chloro-N-(2,2-difluoro-3-hydroxypropyl)-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-N-[[1-(hydroxymethyl)cyclopropyl]methyl]-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-[(3S)-oxolan-3-yl]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-[(3R)-oxolan-3-yl]imidazo[1,2-b]pyridazine-3-carboxamide
CID 158240427
4-[[3-(3-chlorophenyl)imidazo[1,2-b]pyridazin-6-yl]amino]cyclohexan-1-one;(3R)-1-N-[3-(3-chlorophenyl)imidazo[1,2-b]pyridazin-6-yl]cyclohexane-1,3-diamine;4-N-[3-(3-chlorophenyl)imidazo[1,2-b]pyridazin-6-yl]cyclohexane-1,4-diamine;1-[3-(3-chlorophenyl)imidazo[1,2-b]pyridazin-6-yl]piperidin-3-amine;2-(dimethylamino)-1-[4-[[[3-[3-(trifluoromethoxy)phenyl]imidazo[1,2-b]pyridazin-6-yl]amino]methyl]piperidin-1-yl]ethanone;N-(2-morpholin-4-ylethyl)-3-[3-(trifluoromethoxy)phenyl]imidazo[1,2-b]pyridazin-6-amine;[4-[[[3-[3-(trifluoromethoxy)phenyl]imidazo[1,2-b]pyridazin-6-yl]amino]methyl]phenyl]methanol
CID 159016116
2-amino-N-[4-[[4-(dimethylamino)cyclohexyl]methoxy]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[4-(dimethylamino)cyclohexyl]oxy-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[4-[(dimethylamino)methyl]phenoxy]-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-[4-[1-(2-methoxyethyl)piperidin-3-yl]oxy-3-pyridinyl]-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-amino-N-(4-piperidin-4-yloxy-3-pyridinyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 159905012
8-chloro-3-(1,1-difluoroethyl)-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-(1,1-difluoroethyl)-8-(methoxymethyl)-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-(1,1-difluoroethyl)-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazin-7-amine;3-(1,1-difluoroethyl)-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine-7-carboxamide;N-[3-(1,1-difluoroethyl)-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazin-7-yl]acetamide
CID 161126038
7-amino-N-cyclopropyl-5-[[2-(trifluoromethoxy)-3-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;cyclopropanamine;N-cyclopropyl-7-(dibenzylamino)-5-[[2-(trifluoromethoxy)-3-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-(dibenzylamino)-5-[[2-(trifluoromethoxy)-3-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid;ethyl 5-chloro-7-(dibenzylamino)pyrazolo[1,5-a]pyrimidine-3-carboxylate;ethyl 7-(dibenzylamino)-5-[[2-(trifluoromethoxy)-3-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate;2-(trifluoromethoxy)pyridin-3-amine
CID 167619063
N-(2,2-difluorocyclobutyl)-7-(methylamino)-5-[8-(methylamino)imidazo[1,2-a]pyridin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(2R)-2-hydroxycyclobutyl]-5-(6-methoxy-1-propan-2-ylpyrrolo[2,3-b]pyridin-3-yl)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1R,2R)-2-methoxycyclobutyl]-7-(methylamino)-5-[8-(methylamino)imidazo[1,2-a]pyridin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S,2S)-2-methoxycyclobutyl]-7-(methylamino)-5-[8-(methylamino)imidazo[1,2-a]pyridin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(2S)-2-methoxycyclobutyl]-7-(methylamino)-5-[8-(methylamino)imidazo[1,2-a]pyridin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 167691897
6-(2-chlorophenyl)-N-(2-ethyl-6-methyl-4-pyridinyl)imidazo[1,2-b]pyridazine-3-carboxamide;6-(2-chlorophenyl)-N-(6-methoxy-2-pyridinyl)imidazo[1,2-b]pyridazine-3-carboxamide;6-(2-chlorophenyl)-N-(2-methyl-4-pyridinyl)imidazo[1,2-b]pyridazine-3-carboxamide;ethane
CID 144734814
[(3S,4S)-8-[3-[3-chloro-2-[(4-methoxyphenyl)methyl-methylamino]-4-pyridinyl]-5-formyl-1-(oxan-2-yl)pyrazolo[3,4-b]pyrazin-6-yl]-3-methyl-2-oxa-8-azaspiro[4.5]decan-4-yl]carbamic acid
CID 156133517
(2R)-2-aminochloranuidylcyclobutan-1-ol;tert-butyl N-[3-[[(2R)-2-hydroxycyclobutyl]carbamoyl]-5-[(2-methoxy-3-pyridinyl)amino]pyrazolo[1,5-a]pyrimidin-7-yl]-N-methylcarbamate;ethyl 5-chloro-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate;ethyl 5-[(2-methoxy-3-pyridinyl)amino]-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxylate;N-[(2R)-2-hydroxycyclobutyl]-5-[(2-methoxy-3-pyridinyl)amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;methane;2-methoxypyridin-3-amine;5-[(2-methoxy-3-pyridinyl)amino]-7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid
CID 157075614
Deuterio(fluoro)methane;6-(3,5-dimethylanilino)-8-(methylamino)imidazo[1,2-b]pyridazine-3-carboxamide;bis(6-(3,5-dimethylanilino)-8-(methylamino)imidazo[1,2-b]pyridazine-3-carboxylic acid);ethyl 6-(3,5-dimethylanilino)-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxylate
CID 157139067

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-ethyl-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-N-(3-hydroxycyclobutyl)-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(2-methylpropyl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(oxetan-3-yl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-propan-2-ylimidazo[1,2-b]pyridazine-3-carboxamide?
The IUPAC name of 6-chloro-N-ethyl-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-N-(3-hydroxycyclobutyl)-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(2-methylpropyl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(oxetan-3-yl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-propan-2-ylimidazo[1,2-b]pyridazine-3-carboxamide (CID 161469266) is 6-chloro-N-ethyl-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-N-(3-hydroxycyclobutyl)-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(2-methylpropyl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(oxetan-3-yl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-propan-2-ylimidazo[1,2-b]pyridazine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-ethyl-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-N-(3-hydroxycyclobutyl)-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(2-methylpropyl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(oxetan-3-yl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-propan-2-ylimidazo[1,2-b]pyridazine-3-carboxamide?
The canonical SMILES for 6-chloro-N-ethyl-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-N-(3-hydroxycyclobutyl)-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(2-methylpropyl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(oxetan-3-yl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-propan-2-ylimidazo[1,2-b]pyridazine-3-carboxamide is CCNC(=O)c1cnc2c(N(C)Cc3ccc(OC)cc3)cc(Cl)nn12.COc1ccc(CN(C)c2cc(Cl)nn3c(C(=O)NC(C)C)cnc23)cc1.COc1ccc(CN(C)c2cc(Cl)nn3c(C(=O)NC4CC(O)C4)cnc23)cc1.COc1ccc(CN(C)c2cc(Cl)nn3c(C(=O)NC4COC4)cnc23)cc1.COc1ccc(CN(C)c2cc(Cl)nn3c(C(=O)NCC(C)C)cnc23)cc1.
What is the InChIKey of 6-chloro-N-ethyl-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-N-(3-hydroxycyclobutyl)-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(2-methylpropyl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(oxetan-3-yl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-propan-2-ylimidazo[1,2-b]pyridazine-3-carboxamide?
The InChIKey is WCVWCZPQBZAIQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22ClN5O3.C20H24ClN5O2.C19H20ClN5O3.C19H22ClN5O2.C18H20ClN5O2/c1-25(11-12-3-5-15(29-2)6-4-12)16-9-18(21)24-26-17(10-22-19(16)26)20(28)23-13-7-14(27)8-13;1-13(2)10-23-20(27)17-11-22-19-16(9-18(21)24-26(17)19)25(3)12-14-5-7-15(28-4)8-6-14;1-24(9-12-3-5-14(27-2)6-4-12)15-7-17(20)23-25-16(8-21-18(15)25)19(26)22-13-10-28-11-13;1-12(2)22-19(26)16-10-21-18-15(9-17(20)23-25(16)18)24(3)11-13-5-7-14(27-4)8-6-13;1-4-20-18(25)15-10-21-17-14(9-16(19)22-24(15)17)23(2)11-12-5-7-13(26-3)8-6-12/h3-6,9-10,13-14,27H,7-8,11H2,1-2H3,(H,23,28);5-9,11,13H,10,12H2,1-4H3,(H,23,27);3-8,13H,9-11H2,1-2H3,(H,22,26);5-10,12H,11H2,1-4H3,(H,22,26);5-10H,4,11H2,1-3H3,(H,20,25).
What are the key properties of 6-chloro-N-ethyl-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-N-(3-hydroxycyclobutyl)-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(2-methylpropyl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(oxetan-3-yl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-propan-2-ylimidazo[1,2-b]pyridazine-3-carboxamide?
6-chloro-N-ethyl-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-N-(3-hydroxycyclobutyl)-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(2-methylpropyl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(oxetan-3-yl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-propan-2-ylimidazo[1,2-b]pyridazine-3-carboxamide has a molecular weight of 1981.35 g/mol, XLogP of 13.79, 31 rotatable bonds, 6 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-ethyl-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-N-(3-hydroxycyclobutyl)-8-[(4-methoxyphenyl)methyl-methylamino]imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(2-methylpropyl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-(oxetan-3-yl)imidazo[1,2-b]pyridazine-3-carboxamide;6-chloro-8-[(4-methoxyphenyl)methyl-methylamino]-N-propan-2-ylimidazo[1,2-b]pyridazine-3-carboxamide is sourced from PubChem (CID 161469266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).