N,7-dimethyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1,3-thiazol-2-ylmethyl)-1H-indole-2-carboxamide;[7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-1H-indol-2-yl]-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]methanone;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1H-pyrazol-5-ylmethyl)-1H-indole-2-carboxamide;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(pyridin-2-ylmethyl)-1H-indole-2-carboxamide

C97H100N34O5S — CID 159593784

IUPACN,7-dimethyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1,3-thiazol-2-ylmethyl)-1H-indole-2-carboxamide;[7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-1H-indol-2-yl]-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]methanone;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1H-pyrazol-5-ylmethyl)-1H-indole-2-carboxamide;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(pyridin-2-ylmethyl)-1H-indole-2-carboxamide
SMILESCc1cc(Nc2nccc(-c3cn(C)cn3)n2)cc2cc(C(=O)N(C)Cc3nccs3)[nH]c12.Cc1cc(Nc2nccc(-c3cn(C)cn3)n2)cc2cc(C(=O)N3CCN(CCN4CCOCC4)CC3)[nH]c12.Cc1cc(Nc2nccc(-c3cn(C)cn3)n2)cc2cc(C(=O)NCc3ccccn3)[nH]c12.Cc1cc(Nc2nccc(-c3cn(C)cn3)n2)cc2cc(C(=O)NCc3ccn[nH]3)[nH]c12
InChIInChI=1S/C28H35N9O2.C24H22N8O.C23H22N8OS.C22H21N9O/c1-20-15-22(31-28-29-4-3-23(33-28)25-18-34(2)19-30-25)16-21-17-24(32-26(20)21)27(38)37-9-7-35(8-10-37)5-6-36-11-13-39-14-12-36;1-15-9-18(29-24-26-8-6-19(31-24)21-13-32(2)14-28-21)10-16-11-20(30-22(15)16)23(33)27-12-17-5-3-4-7-25-17;1-14-8-16(27-23-25-5-4-17(29-23)19-11-30(2)13-26-19)9-15-10-18(28-21(14)15)22(32)31(3)12-20-24-6-7-33-20;1-13-7-16(27-22-23-5-4-17(29-22)19-11-31(2)12-25-19)8-14-9-18(28-20(13)14)21(32)24-10-15-3-6-26-30-15/h3-4,15-19,32H,5-14H2,1-2H3,(H,29,31,33);3-11,13-14,30H,12H2,1-2H3,(H,27,33)(H,26,29,31);4-11,13,28H,12H2,1-3H3,(H,25,27,29);3-9,11-12,28H,10H2,1-2H3,(H,24,32)(H,26,30)(H,23,27,29)
InChIKeyMKOKIDBCVXMMQX-UHFFFAOYSA-N
MW1854.17 g/mol
LogP13.44
Rot. Bonds25

About N,7-dimethyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1,3-thiazol-2-ylmethyl)-1H-indole-2-carboxamide;[7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-1H-indol-2-yl]-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]methanone;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1H-pyrazol-5-ylmethyl)-1H-indole-2-carboxamide;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(pyridin-2-ylmethyl)-1H-indole-2-carboxamide

N,7-dimethyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1,3-thiazol-2-ylmethyl)-1H-indole-2-carboxamide;[7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-1H-indol-2-yl]-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]methanone;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1H-pyrazol-5-ylmethyl)-1H-indole-2-carboxamide;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(pyridin-2-ylmethyl)-1H-indole-2-carboxamide (PubChem CID 159593784) has the molecular formula C97H100N34O5S and a molecular weight of 1854.17 g/mol. Its IUPAC name is N,7-dimethyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1,3-thiazol-2-ylmethyl)-1H-indole-2-carboxamide;[7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-1H-indol-2-yl]-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]methanone;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1H-pyrazol-5-ylmethyl)-1H-indole-2-carboxamide;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(pyridin-2-ylmethyl)-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN,7-dimethyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1,3-thiazol-2-ylmethyl)-1H-indole-2-carboxamide;[7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-1H-indol-2-yl]-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]methanone;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1H-pyrazol-5-ylmethyl)-1H-indole-2-carboxamide;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(pyridin-2-ylmethyl)-1H-indole-2-carboxamide
PubChem CID159593784
Molecular FormulaC97H100N34O5S
Molecular Weight1854.17 g/mol
Exact Mass1852.83
IUPAC NameN,7-dimethyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1,3-thiazol-2-ylmethyl)-1H-indole-2-carboxamide;[7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-1H-indol-2-yl]-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]methanone;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1H-pyrazol-5-ylmethyl)-1H-indole-2-carboxamide;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(pyridin-2-ylmethyl)-1H-indole-2-carboxamide
SMILESCc1cc(Nc2nccc(-c3cn(C)cn3)n2)cc2cc(C(=O)N(C)Cc3nccs3)[nH]c12.Cc1cc(Nc2nccc(-c3cn(C)cn3)n2)cc2cc(C(=O)N3CCN(CCN4CCOCC4)CC3)[nH]c12.Cc1cc(Nc2nccc(-c3cn(C)cn3)n2)cc2cc(C(=O)NCc3ccccn3)[nH]c12.Cc1cc(Nc2nccc(-c3cn(C)cn3)n2)cc2cc(C(=O)NCc3ccn[nH]3)[nH]c12
InChIInChI=1S/C28H35N9O2.C24H22N8O.C23H22N8OS.C22H21N9O/c1-20-15-22(31-28-29-4-3-23(33-28)25-18-34(2)19-30-25)16-21-17-24(32-26(20)21)27(38)37-9-7-35(8-10-37)5-6-36-11-13-39-14-12-36;1-15-9-18(29-24-26-8-6-19(31-24)21-13-32(2)14-28-21)10-16-11-20(30-22(15)16)23(33)27-12-17-5-3-4-7-25-17;1-14-8-16(27-23-25-5-4-17(29-23)19-11-30(2)13-26-19)9-15-10-18(28-21(14)15)22(32)31(3)12-20-24-6-7-33-20;1-13-7-16(27-22-23-5-4-17(29-22)19-11-31(2)12-25-19)8-14-9-18(28-20(13)14)21(32)24-10-15-3-6-26-30-15/h3-4,15-19,32H,5-14H2,1-2H3,(H,29,31,33);3-11,13-14,30H,12H2,1-2H3,(H,27,33)(H,26,29,31);4-11,13,28H,12H2,1-3H3,(H,25,27,29);3-9,11-12,28H,10H2,1-2H3,(H,24,32)(H,26,30)(H,23,27,29)
InChIKeyMKOKIDBCVXMMQX-UHFFFAOYSA-N
XLogP13.44
TPSA454.67 Ų
H-Bond Donors11
H-Bond Acceptors31
Rotatable Bonds25
Heavy Atoms137
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001854.17
LogP ≤ 513.44
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1031

Analyze N,7-dimethyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1,3-thiazol-2-ylmethyl)-1H-indole-2-carboxamide;[7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-1H-indol-2-yl]-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]methanone;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1H-pyrazol-5-ylmethyl)-1H-indole-2-carboxamide;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(pyridin-2-ylmethyl)-1H-indole-2-carboxamide with MolForge

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Related Compounds

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CID 137387253
(3,3-difluoroazetidin-1-yl)-[1-[[1-methyl-6-[4-[4-(1H-pyrazol-4-yl)anilino]pyrimidin-2-yl]-2-(1,3-thiazol-2-yl)indol-4-yl]methyl]-6-[4-[4-(1H-pyrazol-4-yl)anilino]quinazolin-2-yl]indol-2-yl]methanone
CID 137387573
2-(6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-1-yl)-2-[5-[5-[4-[2-[4-[3-(2,4-dioxo-1,3-diazinan-1-yl)-1H-indazol-6-yl]-3,3-difluoropiperidin-1-yl]acetyl]piperazin-1-yl]-2-pyridinyl]-7-fluoro-3-oxo-1H-isoindol-2-yl]-N-(1,3-thiazol-2-yl)acetamide
CID 156516004
2-(6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-1-yl)-2-[5-[5-[4-[2-[4-[3-(2,4-dioxo-1,3-diazinan-1-yl)-1H-indazol-6-yl]-3,3-difluoropiperidin-1-yl]acetyl]piperazin-1-yl]pyrazin-2-yl]-7-fluoro-3-oxo-1H-isoindol-2-yl]-N-(1,3-thiazol-2-yl)acetamide
CID 157063674
2-(benzylamino)-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]benzamide;tert-butyl 4-[[5-(6-ethyl-1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]carbamoyl]piperidine-1-carboxylate;2-methyl-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide;N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2-phenylbenzamide;N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-1-pyrimidin-2-ylpiperidine-4-carboxamide
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3-anilino-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]pyridine-2-carboxamide;2-methyl-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-4-(trifluoromethyl)-1,3-thiazole-5-carboxamide;N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2-phenylbenzamide;N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2-(2-phenylethyl)benzamide;N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-1-pyrimidin-2-ylpiperidine-4-carboxamide
CID 158570745
N-[4-fluoro-3-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]-4-methyl-3-[4-(2-methyl-1,3-thiazol-5-yl)triazol-1-yl]benzamide;N-[4-fluoro-3-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]-4-methyl-3-[4-(5-morpholin-4-yl-3-pyridinyl)triazol-1-yl]benzamide;4-methyl-N-[3-(4-methylimidazol-1-yl)-5-(trifluoromethyl)phenyl]-3-[4-(1-methylpyrazol-4-yl)triazol-1-yl]benzamide;4-methyl-N-[3-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]-3-[4-(2-methyl-1,3-thiazol-5-yl)triazol-1-yl]benzamide;4-methyl-N-[3-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]-3-[4-(2-oxo-1,3-dihydroimidazo[4,5-b]pyridin-6-yl)triazol-1-yl]benzamide
CID 159011746
2-[4-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)anilino]-6-(2-methylcyclopenten-1-yl)-8-[(4-pyrrolidin-3-yl-3-pyridinyl)methyl]pyrido[2,3-d]pyrimidin-7-one;6-(N-methylanilino)-2-[4-(1-methylpyrrolidin-3-yl)anilino]-8-[(1-methyl-2-pyrrolidin-3-ylpyrrol-3-yl)methyl]pyrido[2,3-d]pyrimidin-7-one;6-(5-methyl-1,3-thiazol-4-yl)-8-[[5-(oxan-4-yl)pyridazin-4-yl]methyl]-2-(4-pyrrolidin-3-ylanilino)pyrido[2,3-d]pyrimidin-7-one;2-[4-piperazin-1-yl-3-(trifluoromethyl)anilino]-6-(pyridin-3-ylamino)-8-[[3-(1,3-thiazol-2-yl)-2-pyridinyl]methyl]pyrido[2,3-d]pyrimidin-7-one
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[(2R)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]cyclohexyl]-(5-fluoro-1H-indazol-3-yl)methanone;[(2R)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]cyclohexyl]-(2-phenyl-1H-imidazol-5-yl)methanone;[(2R)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]cyclohexyl]-(1,3-thiazol-2-yl)methanone;[(2R)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]cyclohexyl]-[2-(trifluoromethyl)phenyl]methanone;[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-(tetrazolo[1,5-a]pyridin-5-yl)methanone
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[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-(5-fluoro-1H-indazol-3-yl)methanone;[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-(2-phenyl-1H-imidazol-5-yl)methanone;[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-(1,3-thiazol-2-yl)methanone;[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-[2-(trifluoromethyl)phenyl]methanone;[(2S)-2-[6-methyl-5-[(3S)-3-methylpyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-2-yl]piperidin-1-yl]-(tetrazolo[1,5-a]pyridin-5-yl)methanimine
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[4-[[(1R)-1-[3-amino-5-(trifluoromethyl)phenyl]ethyl]amino]-2-methylpyrrolo[2,1-f][1,2,4]triazin-6-yl]-morpholin-4-ylmethanone;[7-[[(1R)-1-[3-amino-5-(trifluoromethyl)phenyl]ethyl]amino]-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]-morpholin-4-ylmethanone;N-[(1R)-1-[3-amino-5-(trifluoromethyl)phenyl]ethyl]-2-chloro-6-(cyclohexen-1-yl)-7-methylpyrrolo[2,3-d]pyrimidin-4-amine;N-[(1R)-1-[3-amino-5-(trifluoromethyl)phenyl]ethyl]-6-cyclohexyl-7-methylpyrrolo[2,3-d]pyrimidin-4-amine;6-(cyclohexen-1-yl)-2-methyl-N-[1-[5-[2-(methylaminomethyl)phenyl]thiophen-2-yl]ethyl]pyrrolo[2,1-f][1,2,4]triazin-4-amine
CID 164974987

Frequently Asked Questions

What is the IUPAC name of N,7-dimethyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1,3-thiazol-2-ylmethyl)-1H-indole-2-carboxamide;[7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-1H-indol-2-yl]-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]methanone;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1H-pyrazol-5-ylmethyl)-1H-indole-2-carboxamide;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(pyridin-2-ylmethyl)-1H-indole-2-carboxamide?
The IUPAC name of N,7-dimethyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1,3-thiazol-2-ylmethyl)-1H-indole-2-carboxamide;[7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-1H-indol-2-yl]-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]methanone;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1H-pyrazol-5-ylmethyl)-1H-indole-2-carboxamide;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(pyridin-2-ylmethyl)-1H-indole-2-carboxamide (CID 159593784) is N,7-dimethyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1,3-thiazol-2-ylmethyl)-1H-indole-2-carboxamide;[7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-1H-indol-2-yl]-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]methanone;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1H-pyrazol-5-ylmethyl)-1H-indole-2-carboxamide;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(pyridin-2-ylmethyl)-1H-indole-2-carboxamide.
What is the SMILES notation for N,7-dimethyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1,3-thiazol-2-ylmethyl)-1H-indole-2-carboxamide;[7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-1H-indol-2-yl]-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]methanone;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1H-pyrazol-5-ylmethyl)-1H-indole-2-carboxamide;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(pyridin-2-ylmethyl)-1H-indole-2-carboxamide?
The canonical SMILES for N,7-dimethyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1,3-thiazol-2-ylmethyl)-1H-indole-2-carboxamide;[7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-1H-indol-2-yl]-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]methanone;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1H-pyrazol-5-ylmethyl)-1H-indole-2-carboxamide;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(pyridin-2-ylmethyl)-1H-indole-2-carboxamide is Cc1cc(Nc2nccc(-c3cn(C)cn3)n2)cc2cc(C(=O)N(C)Cc3nccs3)[nH]c12.Cc1cc(Nc2nccc(-c3cn(C)cn3)n2)cc2cc(C(=O)N3CCN(CCN4CCOCC4)CC3)[nH]c12.Cc1cc(Nc2nccc(-c3cn(C)cn3)n2)cc2cc(C(=O)NCc3ccccn3)[nH]c12.Cc1cc(Nc2nccc(-c3cn(C)cn3)n2)cc2cc(C(=O)NCc3ccn[nH]3)[nH]c12.
What is the InChIKey of N,7-dimethyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1,3-thiazol-2-ylmethyl)-1H-indole-2-carboxamide;[7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-1H-indol-2-yl]-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]methanone;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1H-pyrazol-5-ylmethyl)-1H-indole-2-carboxamide;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(pyridin-2-ylmethyl)-1H-indole-2-carboxamide?
The InChIKey is MKOKIDBCVXMMQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H35N9O2.C24H22N8O.C23H22N8OS.C22H21N9O/c1-20-15-22(31-28-29-4-3-23(33-28)25-18-34(2)19-30-25)16-21-17-24(32-26(20)21)27(38)37-9-7-35(8-10-37)5-6-36-11-13-39-14-12-36;1-15-9-18(29-24-26-8-6-19(31-24)21-13-32(2)14-28-21)10-16-11-20(30-22(15)16)23(33)27-12-17-5-3-4-7-25-17;1-14-8-16(27-23-25-5-4-17(29-23)19-11-30(2)13-26-19)9-15-10-18(28-21(14)15)22(32)31(3)12-20-24-6-7-33-20;1-13-7-16(27-22-23-5-4-17(29-22)19-11-31(2)12-25-19)8-14-9-18(28-20(13)14)21(32)24-10-15-3-6-26-30-15/h3-4,15-19,32H,5-14H2,1-2H3,(H,29,31,33);3-11,13-14,30H,12H2,1-2H3,(H,27,33)(H,26,29,31);4-11,13,28H,12H2,1-3H3,(H,25,27,29);3-9,11-12,28H,10H2,1-2H3,(H,24,32)(H,26,30)(H,23,27,29).
What are the key properties of N,7-dimethyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1,3-thiazol-2-ylmethyl)-1H-indole-2-carboxamide;[7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-1H-indol-2-yl]-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]methanone;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1H-pyrazol-5-ylmethyl)-1H-indole-2-carboxamide;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(pyridin-2-ylmethyl)-1H-indole-2-carboxamide?
N,7-dimethyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1,3-thiazol-2-ylmethyl)-1H-indole-2-carboxamide;[7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-1H-indol-2-yl]-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]methanone;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1H-pyrazol-5-ylmethyl)-1H-indole-2-carboxamide;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(pyridin-2-ylmethyl)-1H-indole-2-carboxamide has a molecular weight of 1854.17 g/mol, XLogP of 13.44, 25 rotatable bonds, 11 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for N,7-dimethyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1,3-thiazol-2-ylmethyl)-1H-indole-2-carboxamide;[7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-1H-indol-2-yl]-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]methanone;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(1H-pyrazol-5-ylmethyl)-1H-indole-2-carboxamide;7-methyl-5-[[4-(1-methylimidazol-4-yl)pyrimidin-2-yl]amino]-N-(pyridin-2-ylmethyl)-1H-indole-2-carboxamide is sourced from PubChem (CID 159593784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).