1,1-dimethyl-3-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]urea;N-methyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[5-(propanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;4-methyl-N-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]piperazine-1-carboxamide

C121H113N47O10 — CID 158720473

IUPAC1,1-dimethyl-3-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]urea;N-methyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[5-(propanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;4-methyl-N-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]piperazine-1-carboxamide
SMILESCCC(=O)Cc1ccc(-c2cnc3n[nH]c(-c4nc5c(C(=O)NC)cncc5[nH]4)c3c2)cn1.CCC(=O)Nc1cncc(-c2cnc3n[nH]c(-c4nc5c(C(=O)NC)cncc5[nH]4)c3c2)c1.CN(C)C(=O)Nc1cncc(-c2cnc3n[nH]c(-c4nc5c(C(=O)N6CCCC6)cncc5[nH]4)c3c2)c1.CN1CCN(C(=O)Nc2cncc(-c3cnc4n[nH]c(-c5nc6c(C(=O)N7CCCC7)cncc6[nH]5)c4c3)c2)CC1.CNC(=O)c1cncc2[nH]c(-c3[nH]nc4ncc(-c5cncc(NC(=O)C(C)C)c5)cc34)nc12
InChIInChI=1S/C28H29N11O2.C25H24N10O2.C23H21N9O2.C23H20N8O2.C22H19N9O2/c1-37-6-8-39(9-7-37)28(41)32-19-10-17(12-29-14-19)18-11-20-24(35-36-25(20)31-13-18)26-33-22-16-30-15-21(23(22)34-26)27(40)38-4-2-3-5-38;1-34(2)25(37)29-16-7-14(9-26-11-16)15-8-17-21(32-33-22(17)28-10-15)23-30-19-13-27-12-18(20(19)31-23)24(36)35-5-3-4-6-35;1-11(2)22(33)28-14-4-12(6-25-8-14)13-5-15-19(31-32-20(15)27-7-13)21-29-17-10-26-9-16(18(17)30-21)23(34)24-3;1-3-15(32)7-14-5-4-12(8-26-14)13-6-16-20(30-31-21(16)27-9-13)22-28-18-11-25-10-17(19(18)29-22)23(33)24-2;1-3-17(32)27-13-4-11(6-24-8-13)12-5-14-19(30-31-20(14)26-7-12)21-28-16-10-25-9-15(18(16)29-21)22(33)23-2/h10-16H,2-9H2,1H3,(H,32,41)(H,33,34)(H,31,35,36);7-13H,3-6H2,1-2H3,(H,29,37)(H,30,31)(H,28,32,33);4-11H,1-3H3,(H,24,34)(H,28,33)(H,29,30)(H,27,31,32);4-6,8-11H,3,7H2,1-2H3,(H,24,33)(H,28,29)(H,27,30,31);4-10H,3H2,1-2H3,(H,23,33)(H,27,32)(H,28,29)(H,26,30,31)
InChIKeyIJVVARCGCOOOKH-UHFFFAOYSA-N
MW2385.55 g/mol
LogP14.68
Rot. Bonds24

About 1,1-dimethyl-3-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]urea;N-methyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[5-(propanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;4-methyl-N-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]piperazine-1-carboxamide

1,1-dimethyl-3-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]urea;N-methyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[5-(propanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;4-methyl-N-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]piperazine-1-carboxamide (PubChem CID 158720473) has the molecular formula C121H113N47O10 and a molecular weight of 2385.55 g/mol. Its IUPAC name is 1,1-dimethyl-3-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]urea;N-methyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[5-(propanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;4-methyl-N-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]piperazine-1-carboxamide.

Molecular Properties

Compound Name1,1-dimethyl-3-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]urea;N-methyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[5-(propanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;4-methyl-N-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]piperazine-1-carboxamide
PubChem CID158720473
Molecular FormulaC121H113N47O10
Molecular Weight2385.55 g/mol
Exact Mass2383.98
IUPAC Name1,1-dimethyl-3-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]urea;N-methyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[5-(propanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;4-methyl-N-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]piperazine-1-carboxamide
SMILESCCC(=O)Cc1ccc(-c2cnc3n[nH]c(-c4nc5c(C(=O)NC)cncc5[nH]4)c3c2)cn1.CCC(=O)Nc1cncc(-c2cnc3n[nH]c(-c4nc5c(C(=O)NC)cncc5[nH]4)c3c2)c1.CN(C)C(=O)Nc1cncc(-c2cnc3n[nH]c(-c4nc5c(C(=O)N6CCCC6)cncc5[nH]4)c3c2)c1.CN1CCN(C(=O)Nc2cncc(-c3cnc4n[nH]c(-c5nc6c(C(=O)N7CCCC7)cncc6[nH]5)c4c3)c2)CC1.CNC(=O)c1cncc2[nH]c(-c3[nH]nc4ncc(-c5cncc(NC(=O)C(C)C)c5)cc34)nc12
InChIInChI=1S/C28H29N11O2.C25H24N10O2.C23H21N9O2.C23H20N8O2.C22H19N9O2/c1-37-6-8-39(9-7-37)28(41)32-19-10-17(12-29-14-19)18-11-20-24(35-36-25(20)31-13-18)26-33-22-16-30-15-21(23(22)34-26)27(40)38-4-2-3-5-38;1-34(2)25(37)29-16-7-14(9-26-11-16)15-8-17-21(32-33-22(17)28-10-15)23-30-19-13-27-12-18(20(19)31-23)24(36)35-5-3-4-6-35;1-11(2)22(33)28-14-4-12(6-25-8-14)13-5-15-19(31-32-20(15)27-7-13)21-29-17-10-26-9-16(18(17)30-21)23(34)24-3;1-3-15(32)7-14-5-4-12(8-26-14)13-6-16-20(30-31-21(16)27-9-13)22-28-18-11-25-10-17(19(18)29-22)23(33)24-2;1-3-17(32)27-13-4-11(6-24-8-13)12-5-14-19(30-31-20(14)26-7-12)21-28-16-10-25-9-15(18(16)29-21)22(33)23-2/h10-16H,2-9H2,1H3,(H,32,41)(H,33,34)(H,31,35,36);7-13H,3-6H2,1-2H3,(H,29,37)(H,30,31)(H,28,32,33);4-11H,1-3H3,(H,24,34)(H,28,33)(H,29,30)(H,27,31,32);4-6,8-11H,3,7H2,1-2H3,(H,24,33)(H,28,29)(H,27,30,31);4-10H,3H2,1-2H3,(H,23,33)(H,27,32)(H,28,29)(H,26,30,31)
InChIKeyIJVVARCGCOOOKH-UHFFFAOYSA-N
XLogP14.68
TPSA751.26 Ų
H-Bond Donors17
H-Bond Acceptors36
Rotatable Bonds24
Heavy Atoms178
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002385.55
LogP ≤ 514.68
H-Bond Donors ≤ 517
H-Bond Acceptors ≤ 1036

Analyze 1,1-dimethyl-3-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]urea;N-methyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[5-(propanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;4-methyl-N-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]piperazine-1-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

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CID 59729307
PROTAC CDK2/9 Degrader-1
CID 145925673
1-(4-benzoylpiperazin-1-yl)-2-[7-(triazolo[4,5-b]pyridin-3-yl)-1H-pyrrolo[3,2-b]pyridin-3-yl]ethane-1,2-dione
CID 71517704
[2-(3,5-dimethyl-1H-pyrazol-4-yl)-4-pyridinyl]-(5-piperazin-1-yl-1H-imidazo[4,5-b]pyridin-2-yl)methanone
CID 66599808
2-(2H-indazol-3-yl)-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]acetamide
CID 90683669
N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]-2-(tetrazolo[1,5-b]pyridazin-6-yl)acetamide
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3-methyl-N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridine-5-carboxamide
CID 90683933
N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]-1H-pyrazolo[3,4-b]pyridine-5-carboxamide
CID 90683944
N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]-1H-pyrazolo[5,4-b]pyridine-6-carboxamide
CID 90683964
N-[5-(7-propan-2-ylpyrrolo[2,3-d]pyrimidine-5-carbonyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridine-3-carboxamide
CID 90683969
2-piperidin-4-yl-N-[5-[3-(4-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridin-2-yl)-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]acetamide
CID 137038550
N-[5-[3-[4-(4-methylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-1H-pyrazolo[4,3-b]pyridin-5-yl]-3-pyridinyl]benzamide
CID 137038682

Frequently Asked Questions

What is the IUPAC name of 1,1-dimethyl-3-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]urea;N-methyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[5-(propanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;4-methyl-N-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]piperazine-1-carboxamide?
The IUPAC name of 1,1-dimethyl-3-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]urea;N-methyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[5-(propanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;4-methyl-N-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]piperazine-1-carboxamide (CID 158720473) is 1,1-dimethyl-3-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]urea;N-methyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[5-(propanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;4-methyl-N-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]piperazine-1-carboxamide.
What is the SMILES notation for 1,1-dimethyl-3-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]urea;N-methyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[5-(propanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;4-methyl-N-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]piperazine-1-carboxamide?
The canonical SMILES for 1,1-dimethyl-3-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]urea;N-methyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[5-(propanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;4-methyl-N-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]piperazine-1-carboxamide is CCC(=O)Cc1ccc(-c2cnc3n[nH]c(-c4nc5c(C(=O)NC)cncc5[nH]4)c3c2)cn1.CCC(=O)Nc1cncc(-c2cnc3n[nH]c(-c4nc5c(C(=O)NC)cncc5[nH]4)c3c2)c1.CN(C)C(=O)Nc1cncc(-c2cnc3n[nH]c(-c4nc5c(C(=O)N6CCCC6)cncc5[nH]4)c3c2)c1.CN1CCN(C(=O)Nc2cncc(-c3cnc4n[nH]c(-c5nc6c(C(=O)N7CCCC7)cncc6[nH]5)c4c3)c2)CC1.CNC(=O)c1cncc2[nH]c(-c3[nH]nc4ncc(-c5cncc(NC(=O)C(C)C)c5)cc34)nc12.
What is the InChIKey of 1,1-dimethyl-3-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]urea;N-methyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[5-(propanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;4-methyl-N-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]piperazine-1-carboxamide?
The InChIKey is IJVVARCGCOOOKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H29N11O2.C25H24N10O2.C23H21N9O2.C23H20N8O2.C22H19N9O2/c1-37-6-8-39(9-7-37)28(41)32-19-10-17(12-29-14-19)18-11-20-24(35-36-25(20)31-13-18)26-33-22-16-30-15-21(23(22)34-26)27(40)38-4-2-3-5-38;1-34(2)25(37)29-16-7-14(9-26-11-16)15-8-17-21(32-33-22(17)28-10-15)23-30-19-13-27-12-18(20(19)31-23)24(36)35-5-3-4-6-35;1-11(2)22(33)28-14-4-12(6-25-8-14)13-5-15-19(31-32-20(15)27-7-13)21-29-17-10-26-9-16(18(17)30-21)23(34)24-3;1-3-15(32)7-14-5-4-12(8-26-14)13-6-16-20(30-31-21(16)27-9-13)22-28-18-11-25-10-17(19(18)29-22)23(33)24-2;1-3-17(32)27-13-4-11(6-24-8-13)12-5-14-19(30-31-20(14)26-7-12)21-28-16-10-25-9-15(18(16)29-21)22(33)23-2/h10-16H,2-9H2,1H3,(H,32,41)(H,33,34)(H,31,35,36);7-13H,3-6H2,1-2H3,(H,29,37)(H,30,31)(H,28,32,33);4-11H,1-3H3,(H,24,34)(H,28,33)(H,29,30)(H,27,31,32);4-6,8-11H,3,7H2,1-2H3,(H,24,33)(H,28,29)(H,27,30,31);4-10H,3H2,1-2H3,(H,23,33)(H,27,32)(H,28,29)(H,26,30,31).
What are the key properties of 1,1-dimethyl-3-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]urea;N-methyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[5-(propanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;4-methyl-N-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]piperazine-1-carboxamide?
1,1-dimethyl-3-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]urea;N-methyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[5-(propanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;4-methyl-N-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]piperazine-1-carboxamide has a molecular weight of 2385.55 g/mol, XLogP of 14.68, 24 rotatable bonds, 17 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dimethyl-3-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]urea;N-methyl-2-[5-[5-(2-methylpropanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[6-(2-oxobutyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;N-methyl-2-[5-[5-(propanoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-3H-imidazo[4,5-c]pyridine-7-carboxamide;4-methyl-N-[5-[3-[7-(pyrrolidine-1-carbonyl)-3H-imidazo[4,5-c]pyridin-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]piperazine-1-carboxamide is sourced from PubChem (CID 158720473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).