N-butyl-5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)pyridin-2-amine;bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine);bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine);5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(3-methylsulfonylpropyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine

C134H148Cl8N32O8S4 — CID 161400105

IUPACN-butyl-5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)pyridin-2-amine;bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine);bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine);5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(3-methylsulfonylpropyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine
SMILESCCCCN(C)c1cc(-c2nc3ccccc3n2C)c(Cl)cn1.CCCN(C)c1cc(-c2nc3ccccc3n2C)c(Cl)cn1.CCCNc1cc(-c2nc3ccccc3n2C)c(Cl)cn1.CCCNc1cc(-c2nc3ccccc3n2C)c(Cl)cn1.CN(CCCS(C)(=O)=O)c1cc(-c2nc3ccccc3n2C)c(Cl)cn1.CN(CCS(C)(=O)=O)c1cc(-c2nc3ccccc3n2C)c(Cl)cn1.Cn1c(-c2cc(NCCS(C)(=O)=O)ncc2Cl)nc2ccccc21.Cn1c(-c2cc(NCCS(C)(=O)=O)ncc2Cl)nc2ccccc21
InChIInChI=1S/C18H21ClN4O2S.C18H21ClN4.C17H19ClN4O2S.C17H19ClN4.2C16H17ClN4O2S.2C16H17ClN4/c1-22(9-6-10-26(3,24)25)17-11-13(14(19)12-20-17)18-21-15-7-4-5-8-16(15)23(18)2;1-4-5-10-22(2)17-11-13(14(19)12-20-17)18-21-15-8-6-7-9-16(15)23(18)3;1-21(8-9-25(3,23)24)16-10-12(13(18)11-19-16)17-20-14-6-4-5-7-15(14)22(17)2;1-4-9-21(2)16-10-12(13(18)11-19-16)17-20-14-7-5-6-8-15(14)22(17)3;2*1-21-14-6-4-3-5-13(14)20-16(21)11-9-15(19-10-12(11)17)18-7-8-24(2,22)23;2*1-3-8-18-15-9-11(12(17)10-19-15)16-20-13-6-4-5-7-14(13)21(16)2/h4-5,7-8,11-12H,6,9-10H2,1-3H3;6-9,11-12H,4-5,10H2,1-3H3;4-7,10-11H,8-9H2,1-3H3;5-8,10-11H,4,9H2,1-3H3;2*3-6,9-10H,7-8H2,1-2H3,(H,18,19);2*4-7,9-10H,3,8H2,1-2H3,(H,18,19)
InChIKeyVUCWZCQDBGYBEI-UHFFFAOYSA-N
MW2746.77 g/mol
LogP28.30
Rot. Bonds38

About N-butyl-5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)pyridin-2-amine;bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine);bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine);5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(3-methylsulfonylpropyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine

N-butyl-5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)pyridin-2-amine;bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine);bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine);5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(3-methylsulfonylpropyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine (PubChem CID 161400105) has the molecular formula C134H148Cl8N32O8S4 and a molecular weight of 2746.77 g/mol. Its IUPAC name is N-butyl-5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)pyridin-2-amine;bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine);bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine);5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(3-methylsulfonylpropyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine.

Molecular Properties

Compound NameN-butyl-5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)pyridin-2-amine;bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine);bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine);5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(3-methylsulfonylpropyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine
PubChem CID161400105
Molecular FormulaC134H148Cl8N32O8S4
Molecular Weight2746.77 g/mol
Exact Mass2740.85
IUPAC NameN-butyl-5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)pyridin-2-amine;bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine);bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine);5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(3-methylsulfonylpropyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine
SMILESCCCCN(C)c1cc(-c2nc3ccccc3n2C)c(Cl)cn1.CCCN(C)c1cc(-c2nc3ccccc3n2C)c(Cl)cn1.CCCNc1cc(-c2nc3ccccc3n2C)c(Cl)cn1.CCCNc1cc(-c2nc3ccccc3n2C)c(Cl)cn1.CN(CCCS(C)(=O)=O)c1cc(-c2nc3ccccc3n2C)c(Cl)cn1.CN(CCS(C)(=O)=O)c1cc(-c2nc3ccccc3n2C)c(Cl)cn1.Cn1c(-c2cc(NCCS(C)(=O)=O)ncc2Cl)nc2ccccc21.Cn1c(-c2cc(NCCS(C)(=O)=O)ncc2Cl)nc2ccccc21
InChIInChI=1S/C18H21ClN4O2S.C18H21ClN4.C17H19ClN4O2S.C17H19ClN4.2C16H17ClN4O2S.2C16H17ClN4/c1-22(9-6-10-26(3,24)25)17-11-13(14(19)12-20-17)18-21-15-7-4-5-8-16(15)23(18)2;1-4-5-10-22(2)17-11-13(14(19)12-20-17)18-21-15-8-6-7-9-16(15)23(18)3;1-21(8-9-25(3,23)24)16-10-12(13(18)11-19-16)17-20-14-6-4-5-7-15(14)22(17)2;1-4-9-21(2)16-10-12(13(18)11-19-16)17-20-14-7-5-6-8-15(14)22(17)3;2*1-21-14-6-4-3-5-13(14)20-16(21)11-9-15(19-10-12(11)17)18-7-8-24(2,22)23;2*1-3-8-18-15-9-11(12(17)10-19-15)16-20-13-6-4-5-7-14(13)21(16)2/h4-5,7-8,11-12H,6,9-10H2,1-3H3;6-9,11-12H,4-5,10H2,1-3H3;4-7,10-11H,8-9H2,1-3H3;5-8,10-11H,4,9H2,1-3H3;2*3-6,9-10H,7-8H2,1-2H3,(H,18,19);2*4-7,9-10H,3,8H2,1-2H3,(H,18,19)
InChIKeyVUCWZCQDBGYBEI-UHFFFAOYSA-N
XLogP28.30
TPSA443.32 Ų
H-Bond Donors4
H-Bond Acceptors40
Rotatable Bonds38
Heavy Atoms186
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002746.77
LogP ≤ 528.30
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1040

Analyze N-butyl-5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)pyridin-2-amine;bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine);bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine);5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(3-methylsulfonylpropyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine with MolForge

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Related Compounds

N-[3-[(4-acetylpiperazin-1-yl)methyl]-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-ethylmethanesulfonamide;1-[4-[[2-(4-chlorophenyl)-6-ethylsulfonylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]thiomorpholine;1-[4-[[2-(2,4-dichlorophenyl)-6-(1,1-dioxothiazinan-2-yl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]ethanone;N-[2-(2,4-dichlorophenyl)-3-[(3-oxopiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-yl]-N-methylmethanesulfonamide
CID 157150454
1-chloro-N-[2,4-difluoro-3-[[3-(7H-purin-6-yl)-2-pyridinyl]amino]phenyl]methanesulfonamide;N-[4-chloro-2-fluoro-3-[[3-(7H-purin-6-yl)-2-pyridinyl]amino]phenyl]-3-fluoropropane-1-sulfonamide;N-[2-chloro-4-fluoro-3-[[3-(7H-purin-6-yl)-2-pyridinyl]amino]phenyl]propane-1-sulfonamide;N-[2,4-difluoro-3-[[3-(7H-purin-6-yl)-2-pyridinyl]amino]phenyl]ethanesulfonamide;N-[2,4-difluoro-3-[[3-(7H-purin-6-yl)-2-pyridinyl]amino]phenyl]-3-fluoropropane-1-sulfonamide;N-[2,4-difluoro-3-[[3-(7H-purin-6-yl)-2-pyridinyl]amino]phenyl]methanesulfonamide
CID 157260387
3-bromo-6-(2-chlorophenyl)-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-N-(4-methylsulfonylphenyl)-6-phenylimidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-bromo-6-phenyl-N-(2-pyridin-4-ylethyl)imidazo[1,2-a]pyrazin-8-amine;3-iodo-6-phenyl-N-(pyridin-4-ylmethyl)imidazo[1,2-a]pyrazin-8-amine
CID 157279049
3-Chloro-4-methylbenzenesulfonyl chloride;bis(3-[1-(3-chloro-4-methylphenyl)sulfonylpiperidin-4-yl]-2-(2-chlorophenyl)imidazo[4,5-b]pyridine);2-(2-chlorophenyl)-3-piperidin-4-ylimidazo[4,5-b]pyridine
CID 157558223
N-[3-[(4-acetylpiperazin-1-yl)methyl]-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]ethanesulfonamide;N-[3-[(4-acetylpiperazin-1-yl)methyl]-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-2-methoxyethanesulfonamide;N-[3-[(4-acetylpiperazin-1-yl)methyl]-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylethanesulfonamide;bis(N-[3-[(4-acetylpiperazin-1-yl)methyl]-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]propane-2-sulfonamide)
CID 157572116
1-chloro-N-[2,4-difluoro-3-[[3-(7H-purin-6-yl)-2-pyridinyl]amino]phenyl]methanesulfonamide;N-[4-chloro-2-fluoro-3-[[3-(7H-purin-6-yl)-2-pyridinyl]amino]phenyl]-3-fluoropropane-1-sulfonamide;N-[2-chloro-4-fluoro-3-[[3-(7H-purin-6-yl)-2-pyridinyl]amino]phenyl]propane-1-sulfonamide;N-[4-chloro-2-fluoro-3-[[3-(7H-purin-6-yl)-2-pyridinyl]amino]phenyl]propane-1-sulfonamide;N-[2,4-difluoro-3-[[3-(7H-purin-6-yl)-2-pyridinyl]amino]phenyl]-3-fluoropropane-1-sulfonamide
CID 157866790
N-[5-[(1-ethylpiperidin-4-yl)-methylsulfanylmethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(R)-(1-ethylpiperidin-4-yl)-methylsulfanylmethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(S)-(1-ethylpiperidin-4-yl)-methylsulfanylmethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(1-ethylpiperidin-4-yl)-methylsulfonylmethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(R)-(1-ethylpiperidin-4-yl)-methylsulfonylmethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine
CID 157919849
[4-(aminomethyl)cyclohexyl]methanamine;tris(N-[[4-(aminomethyl)cyclohexyl]methyl]-8-(2-chlorophenyl)-9-(4-chlorophenyl)purin-6-amine);bis(6-chloro-8-(2-chlorophenyl)-9-(4-chlorophenyl)purine);8-(2-chlorophenyl)-9-(4-chlorophenyl)-6-piperidin-1-ylpurine;N-[[4-[[[8-(2-chlorophenyl)-9-(4-chlorophenyl)purin-6-yl]amino]methyl]cyclohexyl]methyl]methanesulfonamide;8-(2-chlorophenyl)-9-(4-chlorophenyl)-6-[[4-[(sulfamoylamino)methyl]cyclohexyl]methylamino]purine;methanesulfonyl chloride;piperidine;sulfamide
CID 157967165
1-(6-chloro-3-pyridinyl)-N,N-dimethylpiperidin-4-amine;5-(3-chloro-4-pyridinyl)-4-N-(1,1-dioxothian-4-yl)pyrimidine-2,4-diamine;N-[5-[4-(dimethylamino)piperidin-1-yl]-2-pyridinyl]-8-(1,1-dioxothian-4-yl)-4,6,8,11-tetrazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaen-5-amine
CID 157978963
N-(benzenesulfonyl)-4-[8-(2-chlorophenyl)-9-(4-chlorophenyl)purin-6-yl]piperazine-1-carboxamide;4-[8-(2-chlorophenyl)-9-(4-chlorophenyl)purin-6-yl]-N-cyclohexylpiperazine-1-sulfonamide;4-[8-(2-chlorophenyl)-9-(4-chlorophenyl)purin-6-yl]-N-cyclohexylsulfonylpiperazine-1-carboxamide;4-[8-(2-chlorophenyl)-9-(4-chlorophenyl)purin-6-yl]-N-phenylpiperazine-1-sulfonamide;1-[8-(2-chlorophenyl)-9-(4-chlorophenyl)purin-6-yl]-N-(phenylsulfamoyl)piperidin-4-amine
CID 158021393
N-[5-[(1-ethylpiperidin-4-yl)-methylsulfanylmethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(R)-(1-ethylpiperidin-4-yl)-methylsulfanylmethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(S)-(1-ethylpiperidin-4-yl)-methylsulfanylmethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(1-ethylpiperidin-4-yl)-methylsulfonylmethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(R)-(1-ethylpiperidin-4-yl)-methylsulfonylmethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(S)-(1-ethylpiperidin-4-yl)-methylsulfonylmethyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine
CID 158103123
N-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]azetidin-3-yl]acetamide;N-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]azetidin-3-yl]methanesulfonamide;4-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]-1-methylpiperazin-2-one;N-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]pyrrolidin-3-yl]acetamide;2-[5-chloro-2-(5-methylidene-1,4-diazepan-1-yl)-4-pyridinyl]-1-methylbenzimidazole;2-(5-chloro-2-piperidin-1-yl-4-pyridinyl)-1-methylbenzimidazole;methyl N-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]azetidin-3-yl]carbamate;methyl N-[1-[5-chloro-4-(1-methylbenzimidazol-2-yl)-2-pyridinyl]piperidin-4-yl]carbamate
CID 158174585

Frequently Asked Questions

What is the IUPAC name of N-butyl-5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)pyridin-2-amine;bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine);bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine);5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(3-methylsulfonylpropyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine?
The IUPAC name of N-butyl-5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)pyridin-2-amine;bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine);bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine);5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(3-methylsulfonylpropyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine (CID 161400105) is N-butyl-5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)pyridin-2-amine;bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine);bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine);5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(3-methylsulfonylpropyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine.
What is the SMILES notation for N-butyl-5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)pyridin-2-amine;bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine);bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine);5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(3-methylsulfonylpropyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine?
The canonical SMILES for N-butyl-5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)pyridin-2-amine;bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine);bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine);5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(3-methylsulfonylpropyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine is CCCCN(C)c1cc(-c2nc3ccccc3n2C)c(Cl)cn1.CCCN(C)c1cc(-c2nc3ccccc3n2C)c(Cl)cn1.CCCNc1cc(-c2nc3ccccc3n2C)c(Cl)cn1.CCCNc1cc(-c2nc3ccccc3n2C)c(Cl)cn1.CN(CCCS(C)(=O)=O)c1cc(-c2nc3ccccc3n2C)c(Cl)cn1.CN(CCS(C)(=O)=O)c1cc(-c2nc3ccccc3n2C)c(Cl)cn1.Cn1c(-c2cc(NCCS(C)(=O)=O)ncc2Cl)nc2ccccc21.Cn1c(-c2cc(NCCS(C)(=O)=O)ncc2Cl)nc2ccccc21.
What is the InChIKey of N-butyl-5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)pyridin-2-amine;bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine);bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine);5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(3-methylsulfonylpropyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine?
The InChIKey is VUCWZCQDBGYBEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21ClN4O2S.C18H21ClN4.C17H19ClN4O2S.C17H19ClN4.2C16H17ClN4O2S.2C16H17ClN4/c1-22(9-6-10-26(3,24)25)17-11-13(14(19)12-20-17)18-21-15-7-4-5-8-16(15)23(18)2;1-4-5-10-22(2)17-11-13(14(19)12-20-17)18-21-15-8-6-7-9-16(15)23(18)3;1-21(8-9-25(3,23)24)16-10-12(13(18)11-19-16)17-20-14-6-4-5-7-15(14)22(17)2;1-4-9-21(2)16-10-12(13(18)11-19-16)17-20-14-7-5-6-8-15(14)22(17)3;2*1-21-14-6-4-3-5-13(14)20-16(21)11-9-15(19-10-12(11)17)18-7-8-24(2,22)23;2*1-3-8-18-15-9-11(12(17)10-19-15)16-20-13-6-4-5-7-14(13)21(16)2/h4-5,7-8,11-12H,6,9-10H2,1-3H3;6-9,11-12H,4-5,10H2,1-3H3;4-7,10-11H,8-9H2,1-3H3;5-8,10-11H,4,9H2,1-3H3;2*3-6,9-10H,7-8H2,1-2H3,(H,18,19);2*4-7,9-10H,3,8H2,1-2H3,(H,18,19).
What are the key properties of N-butyl-5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)pyridin-2-amine;bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine);bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine);5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(3-methylsulfonylpropyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine?
N-butyl-5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)pyridin-2-amine;bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine);bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine);5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(3-methylsulfonylpropyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine has a molecular weight of 2746.77 g/mol, XLogP of 28.30, 38 rotatable bonds, 4 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)pyridin-2-amine;bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine);bis(5-chloro-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine);5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(2-methylsulfonylethyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-(3-methylsulfonylpropyl)pyridin-2-amine;5-chloro-N-methyl-4-(1-methylbenzimidazol-2-yl)-N-propylpyridin-2-amine is sourced from PubChem (CID 161400105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).