N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,4-dimethoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-(pyrrolidin-1-ylmethyl)benzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-7-carboxamide;2-[4-[(2,6-difluorobenzoyl)amino]-1H-pyrazol-5-yl]-1H-benzimidazole-4-carboxylic acid;2,6-difluoro-N-[5-[4-(4-methylpiperazine-1-carbonyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide

C101H84F5N29O10 — CID 159053404

IUPACN-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,4-dimethoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-(pyrrolidin-1-ylmethyl)benzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-7-carboxamide;2-[4-[(2,6-difluorobenzoyl)amino]-1H-pyrazol-5-yl]-1H-benzimidazole-4-carboxylic acid;2,6-difluoro-N-[5-[4-(4-methylpiperazine-1-carbonyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide
SMILESCN1CCN(C(=O)c2cccc3[nH]c(-c4[nH]ncc4NC(=O)c4c(F)cccc4F)nc23)CC1.COc1ccc(C(=O)Nc2cn[nH]c2-c2nc3ccccc3[nH]2)c(OC)c1.O=C(Nc1cn[nH]c1-c1nc2c(C(=O)O)cccc2[nH]1)c1c(F)cccc1F.O=C(Nc1cn[nH]c1-c1nc2ccccc2[nH]1)c1cccc(CN2CCCC2)c1F.O=C(Nc1cn[nH]c1-c1nc2ccccc2[nH]1)c1cccc2cc[nH]c12
InChIInChI=1S/C23H21F2N7O2.C22H21FN6O.C19H14N6O.C19H17N5O3.C18H11F2N5O3/c1-31-8-10-32(11-9-31)23(34)13-4-2-7-16-19(13)29-21(27-16)20-17(12-26-30-20)28-22(33)18-14(24)5-3-6-15(18)25;23-19-14(13-29-10-3-4-11-29)6-5-7-15(19)22(30)27-18-12-24-28-20(18)21-25-16-8-1-2-9-17(16)26-21;26-19(12-5-3-4-11-8-9-20-16(11)12)24-15-10-21-25-17(15)18-22-13-6-1-2-7-14(13)23-18;1-26-11-7-8-12(16(9-11)27-2)19(25)23-15-10-20-24-17(15)18-21-13-5-3-4-6-14(13)22-18;19-9-4-2-5-10(20)13(9)17(26)23-12-7-21-25-15(12)16-22-11-6-1-3-8(18(27)28)14(11)24-16/h2-7,12H,8-11H2,1H3,(H,26,30)(H,27,29)(H,28,33);1-2,5-9,12H,3-4,10-11,13H2,(H,24,28)(H,25,26)(H,27,30);1-10,20H,(H,21,25)(H,22,23)(H,24,26);3-10H,1-2H3,(H,20,24)(H,21,22)(H,23,25);1-7H,(H,21,25)(H,22,24)(H,23,26)(H,27,28)
InChIKeyJXOFQXXIOIHBSM-UHFFFAOYSA-N
MW1958.97 g/mol
LogP16.90
Rot. Bonds21

About N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,4-dimethoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-(pyrrolidin-1-ylmethyl)benzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-7-carboxamide;2-[4-[(2,6-difluorobenzoyl)amino]-1H-pyrazol-5-yl]-1H-benzimidazole-4-carboxylic acid;2,6-difluoro-N-[5-[4-(4-methylpiperazine-1-carbonyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide

N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,4-dimethoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-(pyrrolidin-1-ylmethyl)benzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-7-carboxamide;2-[4-[(2,6-difluorobenzoyl)amino]-1H-pyrazol-5-yl]-1H-benzimidazole-4-carboxylic acid;2,6-difluoro-N-[5-[4-(4-methylpiperazine-1-carbonyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide (PubChem CID 159053404) has the molecular formula C101H84F5N29O10 and a molecular weight of 1958.97 g/mol. Its IUPAC name is N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,4-dimethoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-(pyrrolidin-1-ylmethyl)benzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-7-carboxamide;2-[4-[(2,6-difluorobenzoyl)amino]-1H-pyrazol-5-yl]-1H-benzimidazole-4-carboxylic acid;2,6-difluoro-N-[5-[4-(4-methylpiperazine-1-carbonyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide.

Molecular Properties

Compound NameN-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,4-dimethoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-(pyrrolidin-1-ylmethyl)benzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-7-carboxamide;2-[4-[(2,6-difluorobenzoyl)amino]-1H-pyrazol-5-yl]-1H-benzimidazole-4-carboxylic acid;2,6-difluoro-N-[5-[4-(4-methylpiperazine-1-carbonyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide
PubChem CID159053404
Molecular FormulaC101H84F5N29O10
Molecular Weight1958.97 g/mol
Exact Mass1957.69
IUPAC NameN-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,4-dimethoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-(pyrrolidin-1-ylmethyl)benzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-7-carboxamide;2-[4-[(2,6-difluorobenzoyl)amino]-1H-pyrazol-5-yl]-1H-benzimidazole-4-carboxylic acid;2,6-difluoro-N-[5-[4-(4-methylpiperazine-1-carbonyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide
SMILESCN1CCN(C(=O)c2cccc3[nH]c(-c4[nH]ncc4NC(=O)c4c(F)cccc4F)nc23)CC1.COc1ccc(C(=O)Nc2cn[nH]c2-c2nc3ccccc3[nH]2)c(OC)c1.O=C(Nc1cn[nH]c1-c1nc2c(C(=O)O)cccc2[nH]1)c1c(F)cccc1F.O=C(Nc1cn[nH]c1-c1nc2ccccc2[nH]1)c1cccc(CN2CCCC2)c1F.O=C(Nc1cn[nH]c1-c1nc2ccccc2[nH]1)c1cccc2cc[nH]c12
InChIInChI=1S/C23H21F2N7O2.C22H21FN6O.C19H14N6O.C19H17N5O3.C18H11F2N5O3/c1-31-8-10-32(11-9-31)23(34)13-4-2-7-16-19(13)29-21(27-16)20-17(12-26-30-20)28-22(33)18-14(24)5-3-6-15(18)25;23-19-14(13-29-10-3-4-11-29)6-5-7-15(19)22(30)27-18-12-24-28-20(18)21-25-16-8-1-2-9-17(16)26-21;26-19(12-5-3-4-11-8-9-20-16(11)12)24-15-10-21-25-17(15)18-22-13-6-1-2-7-14(13)23-18;1-26-11-7-8-12(16(9-11)27-2)19(25)23-15-10-20-24-17(15)18-21-13-5-3-4-6-14(13)22-18;19-9-4-2-5-10(20)13(9)17(26)23-12-7-21-25-15(12)16-22-11-6-1-3-8(18(27)28)14(11)24-16/h2-7,12H,8-11H2,1H3,(H,26,30)(H,27,29)(H,28,33);1-2,5-9,12H,3-4,10-11,13H2,(H,24,28)(H,25,26)(H,27,30);1-10,20H,(H,21,25)(H,22,23)(H,24,26);3-10H,1-2H3,(H,20,24)(H,21,22)(H,23,25);1-7H,(H,21,25)(H,22,24)(H,23,26)(H,27,28)
InChIKeyJXOFQXXIOIHBSM-UHFFFAOYSA-N
XLogP16.90
TPSA530.64 Ų
H-Bond Donors17
H-Bond Acceptors21
Rotatable Bonds21
Heavy Atoms145
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001958.97
LogP ≤ 516.90
H-Bond Donors ≤ 517
H-Bond Acceptors ≤ 1021

Analyze N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,4-dimethoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-(pyrrolidin-1-ylmethyl)benzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-7-carboxamide;2-[4-[(2,6-difluorobenzoyl)amino]-1H-pyrazol-5-yl]-1H-benzimidazole-4-carboxylic acid;2,6-difluoro-N-[5-[4-(4-methylpiperazine-1-carbonyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide with MolForge

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Related Compounds

N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,2-difluoro-1,3-benzodioxole-4-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,3-dihydro-1-benzofuran-7-carboxamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-methoxynaphthalene-1-carboxamide;2-[4-[(2,6-difluorobenzoyl)amino]-1H-pyrazol-5-yl]-1H-benzimidazole-4-carboxylic acid;2,6-difluoro-N-[5-(3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazol-4-yl]benzamide;2,6-difluoro-N-[5-[6-(4-propan-2-ylpiperazine-1-carbonyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide
CID 160851026
N-(1H-benzimidazol-4-ylmethyl)-3-ethoxy-N-methyl-4-(1H-pyrazol-5-yl)benzamide;3-(2,2-difluoroethoxy)-N-(1H-indazol-7-ylmethyl)-N-methyl-4-phenylbenzamide;3-(difluoromethoxy)-4-(3-fluorophenyl)-N-(3H-isoindol-4-ylmethyl)-N-methylbenzamide;3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-(2,2,2-trifluoroethyl)benzamide;3-(fluoromethoxy)-4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methylbenzamide;N-(1H-indazol-7-ylmethyl)-3-(methoxymethyl)-N-methyl-4-phenylbenzamide
CID 167555498
2-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-3H-indole-4-carboxylic acid;6-methyl-2-(4-phenylphenyl)-3H-indene-4-carboxylic acid;2-[4-(1-methylpyrazol-4-yl)phenyl]-3H-indole-4-carboxylic acid;6-methyl-2-(2,3,5,6-tetrafluoro-4-phenoxyphenyl)-1H-benzimidazole-4-carboxylic acid;2-[4-(4-phenylmethoxyphenyl)phenyl]-1H-benzimidazole-4-carboxylic acid;2-[4-[4-(pyridin-3-ylmethoxy)phenyl]phenyl]-1H-benzimidazole-4-carboxylic acid;2-(2,3,5,6-tetrafluoro-4-phenoxyphenyl)-1H-benzimidazole-4-carboxylic acid
CID 157079679
1H-benzimidazol-2-amine;N-(1H-benzimidazol-2-yl)-4-[1-[(4-methoxyphenyl)methyl]-3-[[(3R)-1-propanoylpyrrolidin-3-yl]amino]pyrazolo[3,4-b]pyridin-4-yl]oxybenzamide;4-[1-[(4-methoxyphenyl)methyl]-3-[[(3R)-1-propanoylpyrrolidin-3-yl]amino]pyrazolo[3,4-b]pyridin-4-yl]oxybenzoic acid
CID 157084430
N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-4-(2-chloroethyl)benzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-4-(difluoromethoxy)benzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-7-carboxamide;2,6-difluoro-N-[5-[4-(4-methylpiperazine-1-carbonyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide;2,6-difluoro-N-[5-[6-(pyrrolidin-1-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide;1-[5-(5-phenyl-1H-imidazol-2-yl)-1H-pyrazol-4-yl]propan-2-one
CID 157197830
3-[(E)-2-(4-fluorophenyl)ethenyl]-N-[2-(1H-imidazol-5-yl)ethyl]-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(4-fluorophenyl)ethenyl]-N-(3-imidazol-1-ylpropyl)-4-methoxy-2H-indazole-5-carboxamide;3-[(E)-2-(4-fluorophenyl)ethenyl]-4-methoxy-N-(3-morpholin-4-ylpropyl)-2H-indazole-5-carboxamide;3-[(E)-2-(4-fluorophenyl)ethenyl]-4-methoxy-N-[3-(2-oxopyrrolidin-1-yl)propyl]-2H-indazole-5-carboxamide
CID 157688433
6-[(4-amino-7-fluoroquinazolin-6-yl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;6-[(6-fluoro-1H-indazol-5-yl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;4-fluoro-6-[(4-methyl-5-oxo-1H-imidazo[4,5-b]pyridin-7-yl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid;6-[(6-fluoro-2-oxo-1,3-dihydroindol-5-yl)methyl]-8-(2-oxo-1H-pyridin-3-yl)furo[2,3-e]indole-7-carboxylic acid
CID 158171599
N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-chloro-6-fluorobenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-6-methoxybenzamide;N-[5-[4-(chloromethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2-[4-[(2,6-difluorobenzoyl)amino]-1H-pyrazol-5-yl]-3H-benzimidazole-5-carboxylic acid;[2-[4-[(2,6-difluorobenzoyl)amino]-1H-pyrazol-5-yl]-1H-benzimidazol-4-yl]methyl acetate;methyl 2-[4-[(2,6-difluorobenzoyl)amino]-1H-pyrazol-5-yl]-1H-benzimidazole-4-carboxylate
CID 158189063
4-(1H-benzimidazol-2-yl)-3-[1-[3-(dimethylamino)propyl]-5-hydroxyindol-3-yl]-1,2-dihydropyrrol-5-one;3-[1-[3-(dimethylamino)propyl]-5-hydroxyindol-3-yl]-4-(1H-indol-2-yl)-1,2-dihydropyrrol-5-one;3-[1-[3-(dimethylamino)propyl]-5-hydroxyindol-3-yl]-4-(1H-indol-3-yl)-1,2-dihydropyrrol-5-one;3-(5-hydroxy-1H-indol-3-yl)-4-[4-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]-1,2-dihydropyrrol-5-one;3-methoxy-4-[3-[4-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]-1H-indazol-6-yl]phenol
CID 158271002
N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-dimethoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-methylbenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-(2-pyrrolidin-1-ylethoxy)benzamide;2,6-difluoro-N-[5-[6-(4-methylpiperazine-1-carbonyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide;2,6-difluoro-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide
CID 158378137
N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-methylbenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]quinoline-8-carboxamide;N-[5-[6-[(tert-butylamino)methyl]-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2,6-difluorobenzamide;2,6-difluoro-N-[5-[6-[(4-methylpiperazin-1-yl)methyl]-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide
CID 158866382
N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,6-dimethoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-3-methoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-(2-pyrrolidin-1-ylethoxy)benzamide;2,6-difluoro-N-[5-[6-(4-methylpiperazine-1-carbonyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide;2,6-difluoro-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide
CID 159178608

Frequently Asked Questions

What is the IUPAC name of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,4-dimethoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-(pyrrolidin-1-ylmethyl)benzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-7-carboxamide;2-[4-[(2,6-difluorobenzoyl)amino]-1H-pyrazol-5-yl]-1H-benzimidazole-4-carboxylic acid;2,6-difluoro-N-[5-[4-(4-methylpiperazine-1-carbonyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide?
The IUPAC name of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,4-dimethoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-(pyrrolidin-1-ylmethyl)benzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-7-carboxamide;2-[4-[(2,6-difluorobenzoyl)amino]-1H-pyrazol-5-yl]-1H-benzimidazole-4-carboxylic acid;2,6-difluoro-N-[5-[4-(4-methylpiperazine-1-carbonyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide (CID 159053404) is N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,4-dimethoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-(pyrrolidin-1-ylmethyl)benzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-7-carboxamide;2-[4-[(2,6-difluorobenzoyl)amino]-1H-pyrazol-5-yl]-1H-benzimidazole-4-carboxylic acid;2,6-difluoro-N-[5-[4-(4-methylpiperazine-1-carbonyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide.
What is the SMILES notation for N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,4-dimethoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-(pyrrolidin-1-ylmethyl)benzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-7-carboxamide;2-[4-[(2,6-difluorobenzoyl)amino]-1H-pyrazol-5-yl]-1H-benzimidazole-4-carboxylic acid;2,6-difluoro-N-[5-[4-(4-methylpiperazine-1-carbonyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide?
The canonical SMILES for N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,4-dimethoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-(pyrrolidin-1-ylmethyl)benzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-7-carboxamide;2-[4-[(2,6-difluorobenzoyl)amino]-1H-pyrazol-5-yl]-1H-benzimidazole-4-carboxylic acid;2,6-difluoro-N-[5-[4-(4-methylpiperazine-1-carbonyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide is CN1CCN(C(=O)c2cccc3[nH]c(-c4[nH]ncc4NC(=O)c4c(F)cccc4F)nc23)CC1.COc1ccc(C(=O)Nc2cn[nH]c2-c2nc3ccccc3[nH]2)c(OC)c1.O=C(Nc1cn[nH]c1-c1nc2c(C(=O)O)cccc2[nH]1)c1c(F)cccc1F.O=C(Nc1cn[nH]c1-c1nc2ccccc2[nH]1)c1cccc(CN2CCCC2)c1F.O=C(Nc1cn[nH]c1-c1nc2ccccc2[nH]1)c1cccc2cc[nH]c12.
What is the InChIKey of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,4-dimethoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-(pyrrolidin-1-ylmethyl)benzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-7-carboxamide;2-[4-[(2,6-difluorobenzoyl)amino]-1H-pyrazol-5-yl]-1H-benzimidazole-4-carboxylic acid;2,6-difluoro-N-[5-[4-(4-methylpiperazine-1-carbonyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide?
The InChIKey is JXOFQXXIOIHBSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21F2N7O2.C22H21FN6O.C19H14N6O.C19H17N5O3.C18H11F2N5O3/c1-31-8-10-32(11-9-31)23(34)13-4-2-7-16-19(13)29-21(27-16)20-17(12-26-30-20)28-22(33)18-14(24)5-3-6-15(18)25;23-19-14(13-29-10-3-4-11-29)6-5-7-15(19)22(30)27-18-12-24-28-20(18)21-25-16-8-1-2-9-17(16)26-21;26-19(12-5-3-4-11-8-9-20-16(11)12)24-15-10-21-25-17(15)18-22-13-6-1-2-7-14(13)23-18;1-26-11-7-8-12(16(9-11)27-2)19(25)23-15-10-20-24-17(15)18-21-13-5-3-4-6-14(13)22-18;19-9-4-2-5-10(20)13(9)17(26)23-12-7-21-25-15(12)16-22-11-6-1-3-8(18(27)28)14(11)24-16/h2-7,12H,8-11H2,1H3,(H,26,30)(H,27,29)(H,28,33);1-2,5-9,12H,3-4,10-11,13H2,(H,24,28)(H,25,26)(H,27,30);1-10,20H,(H,21,25)(H,22,23)(H,24,26);3-10H,1-2H3,(H,20,24)(H,21,22)(H,23,25);1-7H,(H,21,25)(H,22,24)(H,23,26)(H,27,28).
What are the key properties of N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,4-dimethoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-(pyrrolidin-1-ylmethyl)benzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-7-carboxamide;2-[4-[(2,6-difluorobenzoyl)amino]-1H-pyrazol-5-yl]-1H-benzimidazole-4-carboxylic acid;2,6-difluoro-N-[5-[4-(4-methylpiperazine-1-carbonyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide?
N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,4-dimethoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-(pyrrolidin-1-ylmethyl)benzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-7-carboxamide;2-[4-[(2,6-difluorobenzoyl)amino]-1H-pyrazol-5-yl]-1H-benzimidazole-4-carboxylic acid;2,6-difluoro-N-[5-[4-(4-methylpiperazine-1-carbonyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide has a molecular weight of 1958.97 g/mol, XLogP of 16.90, 21 rotatable bonds, 17 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2,4-dimethoxybenzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-fluoro-3-(pyrrolidin-1-ylmethyl)benzamide;N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-1H-indole-7-carboxamide;2-[4-[(2,6-difluorobenzoyl)amino]-1H-pyrazol-5-yl]-1H-benzimidazole-4-carboxylic acid;2,6-difluoro-N-[5-[4-(4-methylpiperazine-1-carbonyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide is sourced from PubChem (CID 159053404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).