N-[(5-chloro-2H-indazol-3-yl)methyl]-2-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]pyrazolo[4,3-c]pyridin-4-amine;6-[[[2-[(2-methyl-1,3-benzoxazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(1-methylindazol-5-yl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(1-methylindazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine

C156H132ClN45O3 — CID 158362822

IUPACN-[(5-chloro-2H-indazol-3-yl)methyl]-2-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]pyrazolo[4,3-c]pyridin-4-amine;6-[[[2-[(2-methyl-1,3-benzoxazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(1-methylindazol-5-yl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(1-methylindazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine
SMILESCc1nc2ccc(Cn3cc4c(NCc5ccc6c(N)nccc6c5)nccc4n3)cc2o1.Clc1ccc2n[nH]c(CNc3nccc4nn(Cc5ccc(Cn6cccn6)cc5)cc34)c2c1.Cn1ncc2cc(Cn3ncc4c(NCc5ccc6c(N)nccc6c5)nccc43)ccc21.Cn1ncc2ccc(Cn3cc4c(NCc5ccc6c(N)nccc6c5)nccc4n3)cc21.Nc1nccc2cc(CNc3nccc4c3cnn4Cc3ccc(Oc4ccccn4)cc3)ccc12.Nc1nccc2cc(CNc3nccc4nn(Cc5ccc(Oc6ccccn6)cc5)cc34)ccc12
InChIInChI=1S/2C28H23N7O.C25H21ClN8.2C25H22N8.C25H21N7O/c29-27-23-9-6-20(15-21(23)10-13-31-27)16-33-28-24-17-34-35(25(24)11-14-32-28)18-19-4-7-22(8-5-19)36-26-3-1-2-12-30-26;29-27-23-9-6-20(15-21(23)10-13-31-27)16-33-28-24-18-35(34-25(24)11-14-32-28)17-19-4-7-22(8-5-19)36-26-3-1-2-12-30-26;26-19-6-7-22-20(12-19)24(31-30-22)13-28-25-21-16-34(32-23(21)8-10-27-25)15-18-4-2-17(3-5-18)14-33-11-1-9-29-33;1-32-23-11-17(2-4-19(23)13-30-32)14-33-15-21-22(31-33)7-9-28-25(21)29-12-16-3-5-20-18(10-16)6-8-27-24(20)26;1-32-22-5-3-17(11-19(22)13-30-32)15-33-23-7-9-28-25(21(23)14-31-33)29-12-16-2-4-20-18(10-16)6-8-27-24(20)26;1-15-30-22-5-3-17(11-23(22)33-15)13-32-14-20-21(31-32)7-9-28-25(20)29-12-16-2-4-19-18(10-16)6-8-27-24(19)26/h1-15,17H,16,18H2,(H2,29,31)(H,32,33);1-15,18H,16-17H2,(H2,29,31)(H,32,33);1-12,16H,13-15H2,(H,27,28)(H,30,31);2-11,13,15H,12,14H2,1H3,(H2,26,27)(H,28,29);2-11,13-14H,12,15H2,1H3,(H2,26,27)(H,28,29);2-11,14H,12-13H2,1H3,(H2,26,27)(H,28,29)
InChIKeyGTRCOMCWVVDOPU-UHFFFAOYSA-N
MW2720.54 g/mol
LogP28.57
Rot. Bonds36

About N-[(5-chloro-2H-indazol-3-yl)methyl]-2-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]pyrazolo[4,3-c]pyridin-4-amine;6-[[[2-[(2-methyl-1,3-benzoxazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(1-methylindazol-5-yl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(1-methylindazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine

N-[(5-chloro-2H-indazol-3-yl)methyl]-2-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]pyrazolo[4,3-c]pyridin-4-amine;6-[[[2-[(2-methyl-1,3-benzoxazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(1-methylindazol-5-yl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(1-methylindazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine (PubChem CID 158362822) has the molecular formula C156H132ClN45O3 and a molecular weight of 2720.54 g/mol. Its IUPAC name is N-[(5-chloro-2H-indazol-3-yl)methyl]-2-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]pyrazolo[4,3-c]pyridin-4-amine;6-[[[2-[(2-methyl-1,3-benzoxazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(1-methylindazol-5-yl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(1-methylindazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine.

Molecular Properties

Compound NameN-[(5-chloro-2H-indazol-3-yl)methyl]-2-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]pyrazolo[4,3-c]pyridin-4-amine;6-[[[2-[(2-methyl-1,3-benzoxazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(1-methylindazol-5-yl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(1-methylindazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine
PubChem CID158362822
Molecular FormulaC156H132ClN45O3
Molecular Weight2720.54 g/mol
Exact Mass2718.12
IUPAC NameN-[(5-chloro-2H-indazol-3-yl)methyl]-2-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]pyrazolo[4,3-c]pyridin-4-amine;6-[[[2-[(2-methyl-1,3-benzoxazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(1-methylindazol-5-yl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(1-methylindazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine
SMILESCc1nc2ccc(Cn3cc4c(NCc5ccc6c(N)nccc6c5)nccc4n3)cc2o1.Clc1ccc2n[nH]c(CNc3nccc4nn(Cc5ccc(Cn6cccn6)cc5)cc34)c2c1.Cn1ncc2cc(Cn3ncc4c(NCc5ccc6c(N)nccc6c5)nccc43)ccc21.Cn1ncc2ccc(Cn3cc4c(NCc5ccc6c(N)nccc6c5)nccc4n3)cc21.Nc1nccc2cc(CNc3nccc4c3cnn4Cc3ccc(Oc4ccccn4)cc3)ccc12.Nc1nccc2cc(CNc3nccc4nn(Cc5ccc(Oc6ccccn6)cc5)cc34)ccc12
InChIInChI=1S/2C28H23N7O.C25H21ClN8.2C25H22N8.C25H21N7O/c29-27-23-9-6-20(15-21(23)10-13-31-27)16-33-28-24-17-34-35(25(24)11-14-32-28)18-19-4-7-22(8-5-19)36-26-3-1-2-12-30-26;29-27-23-9-6-20(15-21(23)10-13-31-27)16-33-28-24-18-35(34-25(24)11-14-32-28)17-19-4-7-22(8-5-19)36-26-3-1-2-12-30-26;26-19-6-7-22-20(12-19)24(31-30-22)13-28-25-21-16-34(32-23(21)8-10-27-25)15-18-4-2-17(3-5-18)14-33-11-1-9-29-33;1-32-23-11-17(2-4-19(23)13-30-32)14-33-15-21-22(31-33)7-9-28-25(21)29-12-16-3-5-20-18(10-16)6-8-27-24(20)26;1-32-22-5-3-17(11-19(22)13-30-32)15-33-23-7-9-28-25(21(23)14-31-33)29-12-16-2-4-20-18(10-16)6-8-27-24(20)26;1-15-30-22-5-3-17(11-23(22)33-15)13-32-14-20-21(31-32)7-9-28-25(20)29-12-16-2-4-19-18(10-16)6-8-27-24(19)26/h1-15,17H,16,18H2,(H2,29,31)(H,32,33);1-15,18H,16-17H2,(H2,29,31)(H,32,33);1-12,16H,13-15H2,(H,27,28)(H,30,31);2-11,13,15H,12,14H2,1H3,(H2,26,27)(H,28,29);2-11,13-14H,12,15H2,1H3,(H2,26,27)(H,28,29);2-11,14H,12-13H2,1H3,(H2,26,27)(H,28,29)
InChIKeyGTRCOMCWVVDOPU-UHFFFAOYSA-N
XLogP28.57
TPSA603.40 Ų
H-Bond Donors12
H-Bond Acceptors47
Rotatable Bonds36
Heavy Atoms205
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002720.54
LogP ≤ 528.57
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1047

Analyze N-[(5-chloro-2H-indazol-3-yl)methyl]-2-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]pyrazolo[4,3-c]pyridin-4-amine;6-[[[2-[(2-methyl-1,3-benzoxazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(1-methylindazol-5-yl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(1-methylindazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine with MolForge

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Related Compounds

6-[7-(difluoromethyl)-1-[6-(methylcarbamoylamino)-2-pyridinyl]-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinolin-3-yl]-2-[6-[8-[7-(difluoromethyl)-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]-2-(methylcarbamoyl)quinolin-5-yl]-3-(1-methylpyrazol-4-yl)isoquinolin-8-yl]-N-methyl-1,3-benzoxazole-4-carboxamide
CID 132181505
7-N-[(4-acetylphenyl)methyl]-5-N-[(3-chloro-4-fluorophenyl)methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(4-acetylphenyl)methyl]-5-N-[[3-(difluoromethoxy)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(4-acetylphenyl)methyl]-5-N-[(3,4-difluorophenyl)methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(4-acetylphenyl)methyl]-5-N-[(4-fluoro-3-methylphenyl)methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(4-acetylphenyl)methyl]-5-N-[(4-fluorophenyl)methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(4-acetylphenyl)methyl]-5-N-[[3-(trifluoromethoxy)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(4-acetylphenyl)methyl]-5-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;5-N-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]-7-N-[[4-(1H-1,2,4-triazol-5-yl)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide
CID 157273992
CID 157289626
CID 157289626
CID 157696988
CID 157696988
CID 158932832
CID 158932832
7-N-[(4-acetyl-3-methylphenyl)methyl]-5-N-[(3-chloro-4-fluorophenyl)methyl]-3-fluoropyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(4-acetyl-3-methylphenyl)methyl]-5-N-[[3-(difluoromethoxy)phenyl]methyl]-3-fluoropyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(4-acetyl-3-methylphenyl)methyl]-3-fluoro-5-N-[(4-fluorophenyl)methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(4-acetyl-3-methylphenyl)methyl]-3-fluoro-5-N-[[3-(trifluoromethoxy)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(4-acetyl-3-methylphenyl)methyl]-3-fluoro-5-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(4-acetyl-3-methylphenyl)methyl]-5-N-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide
CID 159023091
CID 159050856
CID 159050856
CID 159486048
CID 159486048
CID 159559892
CID 159559892
7-N-[(4-acetylphenyl)methyl]-5-N-[(4-fluorophenyl)methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(4-acetylphenyl)methyl]-5-N-[[3-(trifluoromethoxy)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(4-acetylphenyl)methyl]-5-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;5-N-[(3-chloro-4-fluorophenyl)methyl]-7-N-[[4-(1H-1,2,4-triazol-5-yl)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;5-N-[(3,4-difluorophenyl)methyl]-7-N-[[4-(1H-1,2,4-triazol-5-yl)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;5-N-[(4-fluoro-3-methylphenyl)methyl]-7-N-[[4-(1H-1,2,4-triazol-5-yl)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;5-N-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]-7-N-[[4-(1H-1,2,4-triazol-5-yl)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide
CID 159975927
CID 160619109
CID 160619109
7-N-[(4-acetyl-3-methylphenyl)methyl]-5-N-[(3-chloro-4-fluorophenyl)methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(4-acetyl-3-methylphenyl)methyl]-5-N-[[3-(difluoromethoxy)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(4-acetyl-3-methylphenyl)methyl]-5-N-[(3,4-difluorophenyl)methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(4-acetyl-3-methylphenyl)methyl]-3-fluoro-5-N-[(4-fluorophenyl)methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(4-acetyl-3-methylphenyl)methyl]-5-N-[(4-fluoro-3-methylphenyl)methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(4-acetyl-3-methylphenyl)methyl]-5-N-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(4-acetyl-3-methylphenyl)methyl]-5-N-[[3-(trifluoromethoxy)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide
CID 161617193

Frequently Asked Questions

What is the IUPAC name of N-[(5-chloro-2H-indazol-3-yl)methyl]-2-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]pyrazolo[4,3-c]pyridin-4-amine;6-[[[2-[(2-methyl-1,3-benzoxazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(1-methylindazol-5-yl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(1-methylindazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine?
The IUPAC name of N-[(5-chloro-2H-indazol-3-yl)methyl]-2-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]pyrazolo[4,3-c]pyridin-4-amine;6-[[[2-[(2-methyl-1,3-benzoxazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(1-methylindazol-5-yl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(1-methylindazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine (CID 158362822) is N-[(5-chloro-2H-indazol-3-yl)methyl]-2-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]pyrazolo[4,3-c]pyridin-4-amine;6-[[[2-[(2-methyl-1,3-benzoxazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(1-methylindazol-5-yl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(1-methylindazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine.
What is the SMILES notation for N-[(5-chloro-2H-indazol-3-yl)methyl]-2-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]pyrazolo[4,3-c]pyridin-4-amine;6-[[[2-[(2-methyl-1,3-benzoxazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(1-methylindazol-5-yl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(1-methylindazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine?
The canonical SMILES for N-[(5-chloro-2H-indazol-3-yl)methyl]-2-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]pyrazolo[4,3-c]pyridin-4-amine;6-[[[2-[(2-methyl-1,3-benzoxazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(1-methylindazol-5-yl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(1-methylindazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine is Cc1nc2ccc(Cn3cc4c(NCc5ccc6c(N)nccc6c5)nccc4n3)cc2o1.Clc1ccc2n[nH]c(CNc3nccc4nn(Cc5ccc(Cn6cccn6)cc5)cc34)c2c1.Cn1ncc2cc(Cn3ncc4c(NCc5ccc6c(N)nccc6c5)nccc43)ccc21.Cn1ncc2ccc(Cn3cc4c(NCc5ccc6c(N)nccc6c5)nccc4n3)cc21.Nc1nccc2cc(CNc3nccc4c3cnn4Cc3ccc(Oc4ccccn4)cc3)ccc12.Nc1nccc2cc(CNc3nccc4nn(Cc5ccc(Oc6ccccn6)cc5)cc34)ccc12.
What is the InChIKey of N-[(5-chloro-2H-indazol-3-yl)methyl]-2-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]pyrazolo[4,3-c]pyridin-4-amine;6-[[[2-[(2-methyl-1,3-benzoxazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(1-methylindazol-5-yl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(1-methylindazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine?
The InChIKey is GTRCOMCWVVDOPU-UHFFFAOYSA-N. The full InChI is InChI=1S/2C28H23N7O.C25H21ClN8.2C25H22N8.C25H21N7O/c29-27-23-9-6-20(15-21(23)10-13-31-27)16-33-28-24-17-34-35(25(24)11-14-32-28)18-19-4-7-22(8-5-19)36-26-3-1-2-12-30-26;29-27-23-9-6-20(15-21(23)10-13-31-27)16-33-28-24-18-35(34-25(24)11-14-32-28)17-19-4-7-22(8-5-19)36-26-3-1-2-12-30-26;26-19-6-7-22-20(12-19)24(31-30-22)13-28-25-21-16-34(32-23(21)8-10-27-25)15-18-4-2-17(3-5-18)14-33-11-1-9-29-33;1-32-23-11-17(2-4-19(23)13-30-32)14-33-15-21-22(31-33)7-9-28-25(21)29-12-16-3-5-20-18(10-16)6-8-27-24(20)26;1-32-22-5-3-17(11-19(22)13-30-32)15-33-23-7-9-28-25(21(23)14-31-33)29-12-16-2-4-20-18(10-16)6-8-27-24(20)26;1-15-30-22-5-3-17(11-23(22)33-15)13-32-14-20-21(31-32)7-9-28-25(20)29-12-16-2-4-19-18(10-16)6-8-27-24(19)26/h1-15,17H,16,18H2,(H2,29,31)(H,32,33);1-15,18H,16-17H2,(H2,29,31)(H,32,33);1-12,16H,13-15H2,(H,27,28)(H,30,31);2-11,13,15H,12,14H2,1H3,(H2,26,27)(H,28,29);2-11,13-14H,12,15H2,1H3,(H2,26,27)(H,28,29);2-11,14H,12-13H2,1H3,(H2,26,27)(H,28,29).
What are the key properties of N-[(5-chloro-2H-indazol-3-yl)methyl]-2-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]pyrazolo[4,3-c]pyridin-4-amine;6-[[[2-[(2-methyl-1,3-benzoxazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(1-methylindazol-5-yl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(1-methylindazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine?
N-[(5-chloro-2H-indazol-3-yl)methyl]-2-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]pyrazolo[4,3-c]pyridin-4-amine;6-[[[2-[(2-methyl-1,3-benzoxazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(1-methylindazol-5-yl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(1-methylindazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine has a molecular weight of 2720.54 g/mol, XLogP of 28.57, 36 rotatable bonds, 12 hydrogen bond donors, and 47 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-chloro-2H-indazol-3-yl)methyl]-2-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]pyrazolo[4,3-c]pyridin-4-amine;6-[[[2-[(2-methyl-1,3-benzoxazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(1-methylindazol-5-yl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(1-methylindazol-6-yl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[1-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,5-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine;6-[[[2-[(4-pyridin-2-yloxyphenyl)methyl]pyrazolo[4,3-c]pyridin-4-yl]amino]methyl]isoquinolin-1-amine is sourced from PubChem (CID 158362822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).