bis(N-(2-aminophenyl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);bis(N-(2-aminophenyl)-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);N-methyl-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-methyl-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide

C125H108N34O6S12 — CID 158938366

IUPACbis(N-(2-aminophenyl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);bis(N-(2-aminophenyl)-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);N-methyl-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-methyl-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide
SMILESCNC(=O)c1ccc(Nc2nc(-c3c(C)nc4ccccn34)c(C)s2)s1.CNC(=O)c1ccc(Nc2nc(-c3c(C)nc4ccccn34)cs2)s1.Cc1nc2ccccn2c1-c1csc(Nc2ccc(C(=O)Nc3ccccc3N)s2)n1.Cc1nc2ccccn2c1-c1csc(Nc2ccc(C(=O)Nc3ccccc3N)s2)n1.Cc1nc2ccccn2c1-c1nc(Nc2ccc(C(=O)Nc3ccccc3N)s2)sc1C.Cc1nc2ccccn2c1-c1nc(Nc2ccc(C(=O)Nc3ccccc3N)s2)sc1C
InChIInChI=1S/2C23H20N6OS2.2C22H18N6OS2.C18H17N5OS2.C17H15N5OS2/c2*1-13-21(29-12-6-5-9-18(29)25-13)20-14(2)31-23(28-20)27-19-11-10-17(32-19)22(30)26-16-8-4-3-7-15(16)24;2*1-13-20(28-11-5-4-8-18(28)24-13)16-12-30-22(26-16)27-19-10-9-17(31-19)21(29)25-15-7-3-2-6-14(15)23;1-10-16(23-9-5-4-6-13(23)20-10)15-11(2)25-18(22-15)21-14-8-7-12(26-14)17(24)19-3;1-10-15(22-8-4-3-5-13(22)19-10)11-9-24-17(20-11)21-14-7-6-12(25-14)16(23)18-2/h2*3-12H,24H2,1-2H3,(H,26,30)(H,27,28);2*2-12H,23H2,1H3,(H,25,29)(H,26,27);4-9H,1-3H3,(H,19,24)(H,21,22);3-9H,1-2H3,(H,18,23)(H,20,21)
InChIKeyJJXXZOTXGZUOCP-UHFFFAOYSA-N
MW2567.27 g/mol
LogP30.41
Rot. Bonds28

About bis(N-(2-aminophenyl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);bis(N-(2-aminophenyl)-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);N-methyl-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-methyl-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide

bis(N-(2-aminophenyl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);bis(N-(2-aminophenyl)-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);N-methyl-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-methyl-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide (PubChem CID 158938366) has the molecular formula C125H108N34O6S12 and a molecular weight of 2567.27 g/mol. Its IUPAC name is bis(N-(2-aminophenyl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);bis(N-(2-aminophenyl)-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);N-methyl-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-methyl-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide.

Molecular Properties

Compound Namebis(N-(2-aminophenyl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);bis(N-(2-aminophenyl)-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);N-methyl-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-methyl-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide
PubChem CID158938366
Molecular FormulaC125H108N34O6S12
Molecular Weight2567.27 g/mol
Exact Mass2564.58
IUPAC Namebis(N-(2-aminophenyl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);bis(N-(2-aminophenyl)-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);N-methyl-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-methyl-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide
SMILESCNC(=O)c1ccc(Nc2nc(-c3c(C)nc4ccccn34)c(C)s2)s1.CNC(=O)c1ccc(Nc2nc(-c3c(C)nc4ccccn34)cs2)s1.Cc1nc2ccccn2c1-c1csc(Nc2ccc(C(=O)Nc3ccccc3N)s2)n1.Cc1nc2ccccn2c1-c1csc(Nc2ccc(C(=O)Nc3ccccc3N)s2)n1.Cc1nc2ccccn2c1-c1nc(Nc2ccc(C(=O)Nc3ccccc3N)s2)sc1C.Cc1nc2ccccn2c1-c1nc(Nc2ccc(C(=O)Nc3ccccc3N)s2)sc1C
InChIInChI=1S/2C23H20N6OS2.2C22H18N6OS2.C18H17N5OS2.C17H15N5OS2/c2*1-13-21(29-12-6-5-9-18(29)25-13)20-14(2)31-23(28-20)27-19-11-10-17(32-19)22(30)26-16-8-4-3-7-15(16)24;2*1-13-20(28-11-5-4-8-18(28)24-13)16-12-30-22(26-16)27-19-10-9-17(31-19)21(29)25-15-7-3-2-6-14(15)23;1-10-16(23-9-5-4-6-13(23)20-10)15-11(2)25-18(22-15)21-14-8-7-12(26-14)17(24)19-3;1-10-15(22-8-4-3-5-13(22)19-10)11-9-24-17(20-11)21-14-7-6-12(25-14)16(23)18-2/h2*3-12H,24H2,1-2H3,(H,26,30)(H,27,28);2*2-12H,23H2,1H3,(H,25,29)(H,26,27);4-9H,1-3H3,(H,19,24)(H,21,22);3-9H,1-2H3,(H,18,23)(H,20,21)
InChIKeyJJXXZOTXGZUOCP-UHFFFAOYSA-N
XLogP30.41
TPSA532.00 Ų
H-Bond Donors16
H-Bond Acceptors46
Rotatable Bonds28
Heavy Atoms177
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002567.27
LogP ≤ 530.41
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1046

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze bis(N-(2-aminophenyl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);bis(N-(2-aminophenyl)-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);N-methyl-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-methyl-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of bis(N-(2-aminophenyl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);bis(N-(2-aminophenyl)-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);N-methyl-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-methyl-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide?
The IUPAC name of bis(N-(2-aminophenyl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);bis(N-(2-aminophenyl)-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);N-methyl-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-methyl-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide (CID 158938366) is bis(N-(2-aminophenyl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);bis(N-(2-aminophenyl)-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);N-methyl-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-methyl-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide.
What is the SMILES notation for bis(N-(2-aminophenyl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);bis(N-(2-aminophenyl)-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);N-methyl-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-methyl-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide?
The canonical SMILES for bis(N-(2-aminophenyl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);bis(N-(2-aminophenyl)-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);N-methyl-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-methyl-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide is CNC(=O)c1ccc(Nc2nc(-c3c(C)nc4ccccn34)c(C)s2)s1.CNC(=O)c1ccc(Nc2nc(-c3c(C)nc4ccccn34)cs2)s1.Cc1nc2ccccn2c1-c1csc(Nc2ccc(C(=O)Nc3ccccc3N)s2)n1.Cc1nc2ccccn2c1-c1csc(Nc2ccc(C(=O)Nc3ccccc3N)s2)n1.Cc1nc2ccccn2c1-c1nc(Nc2ccc(C(=O)Nc3ccccc3N)s2)sc1C.Cc1nc2ccccn2c1-c1nc(Nc2ccc(C(=O)Nc3ccccc3N)s2)sc1C.
What is the InChIKey of bis(N-(2-aminophenyl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);bis(N-(2-aminophenyl)-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);N-methyl-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-methyl-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide?
The InChIKey is JJXXZOTXGZUOCP-UHFFFAOYSA-N. The full InChI is InChI=1S/2C23H20N6OS2.2C22H18N6OS2.C18H17N5OS2.C17H15N5OS2/c2*1-13-21(29-12-6-5-9-18(29)25-13)20-14(2)31-23(28-20)27-19-11-10-17(32-19)22(30)26-16-8-4-3-7-15(16)24;2*1-13-20(28-11-5-4-8-18(28)24-13)16-12-30-22(26-16)27-19-10-9-17(31-19)21(29)25-15-7-3-2-6-14(15)23;1-10-16(23-9-5-4-6-13(23)20-10)15-11(2)25-18(22-15)21-14-8-7-12(26-14)17(24)19-3;1-10-15(22-8-4-3-5-13(22)19-10)11-9-24-17(20-11)21-14-7-6-12(25-14)16(23)18-2/h2*3-12H,24H2,1-2H3,(H,26,30)(H,27,28);2*2-12H,23H2,1H3,(H,25,29)(H,26,27);4-9H,1-3H3,(H,19,24)(H,21,22);3-9H,1-2H3,(H,18,23)(H,20,21).
What are the key properties of bis(N-(2-aminophenyl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);bis(N-(2-aminophenyl)-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);N-methyl-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-methyl-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide?
bis(N-(2-aminophenyl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);bis(N-(2-aminophenyl)-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);N-methyl-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-methyl-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide has a molecular weight of 2567.27 g/mol, XLogP of 30.41, 28 rotatable bonds, 16 hydrogen bond donors, and 46 hydrogen bond acceptors.
Where does this data come from?
All data for bis(N-(2-aminophenyl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);bis(N-(2-aminophenyl)-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide);N-methyl-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-methyl-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide is sourced from PubChem (CID 158938366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).