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

C51H42N16O2S4 — CID 157084370

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

N-(4-amino-1-phenylpyrazol-3-yl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-(4-amino-1-phenylpyrazol-3-yl)-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide (PubChem CID 157084370) has the molecular formula C51H42N16O2S4 and a molecular weight of 1039.27 g/mol. Its IUPAC name is N-(4-amino-1-phenylpyrazol-3-yl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-(4-amino-1-phenylpyrazol-3-yl)-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide.

Molecular Properties

• Compound Name: N-(4-amino-1-phenylpyrazol-3-yl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-(4-amino-1-phenylpyrazol-3-yl)-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide
• PubChem CID: 157084370
• Molecular Formula: C51H42N16O2S4
• Molecular Weight: 1039.27 g/mol
• Exact Mass: 1038.26
• IUPAC Name: N-(4-amino-1-phenylpyrazol-3-yl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-(4-amino-1-phenylpyrazol-3-yl)-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide
• SMILES: Cc1nc2ccccn2c1-c1csc(Nc2ccc(C(=O)Nc3nn(-c4ccccc4)cc3N)s2)n1.Cc1nc2ccccn2c1-c1nc(Nc2ccc(C(=O)Nc3nn(-c4ccccc4)cc3N)s2)sc1C
• InChI: InChI=1S/C26H22N8OS2.C25H20N8OS2/c1-15-23(33-13-7-6-10-20(33)28-15)22-16(2)36-26(30-22)29-21-12-11-19(37-21)25(35)31-24-18(27)14-34(32-24)17-8-4-3-5-9-17;1-15-22(32-12-6-5-9-20(32)27-15)18-14-35-25(28-18)29-21-11-10-19(36-21)24(34)30-23-17(26)13-33(31-23)16-7-3-2-4-8-16/h3-14H,27H2,1-2H3,(H,29,30)(H,31,32,35);2-14H,26H2,1H3,(H,28,29)(H,30,31,34)
• InChIKey: ADXNWASQBORGHY-UHFFFAOYSA-N
• XLogP: 11.49
• TPSA: 230.32 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 20
• Rotatable Bonds: 12
• Heavy Atoms: 73
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1039.27
LogP ≤ 5	11.49
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	20

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-1-phenylpyrazol-3-yl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-(4-amino-1-phenylpyrazol-3-yl)-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 N-(4-amino-1-phenylpyrazol-3-yl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-(4-amino-1-phenylpyrazol-3-yl)-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide (CID 157084370) is N-(4-amino-1-phenylpyrazol-3-yl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-(4-amino-1-phenylpyrazol-3-yl)-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 N-(4-amino-1-phenylpyrazol-3-yl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-(4-amino-1-phenylpyrazol-3-yl)-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 N-(4-amino-1-phenylpyrazol-3-yl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-(4-amino-1-phenylpyrazol-3-yl)-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide is Cc1nc2ccccn2c1-c1csc(Nc2ccc(C(=O)Nc3nn(-c4ccccc4)cc3N)s2)n1.Cc1nc2ccccn2c1-c1nc(Nc2ccc(C(=O)Nc3nn(-c4ccccc4)cc3N)s2)sc1C.

What is the InChIKey of N-(4-amino-1-phenylpyrazol-3-yl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-(4-amino-1-phenylpyrazol-3-yl)-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide?

The InChIKey is ADXNWASQBORGHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H22N8OS2.C25H20N8OS2/c1-15-23(33-13-7-6-10-20(33)28-15)22-16(2)36-26(30-22)29-21-12-11-19(37-21)25(35)31-24-18(27)14-34(32-24)17-8-4-3-5-9-17;1-15-22(32-12-6-5-9-20(32)27-15)18-14-35-25(28-18)29-21-11-10-19(36-21)24(34)30-23-17(26)13-33(31-23)16-7-3-2-4-8-16/h3-14H,27H2,1-2H3,(H,29,30)(H,31,32,35);2-14H,26H2,1H3,(H,28,29)(H,30,31,34).

What are the key properties of N-(4-amino-1-phenylpyrazol-3-yl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-(4-amino-1-phenylpyrazol-3-yl)-5-[[5-methyl-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide?

N-(4-amino-1-phenylpyrazol-3-yl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-(4-amino-1-phenylpyrazol-3-yl)-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 1039.27 g/mol, XLogP of 11.49, 12 rotatable bonds, 6 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-amino-1-phenylpyrazol-3-yl)-5-[[4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]amino]thiophene-2-carboxamide;N-(4-amino-1-phenylpyrazol-3-yl)-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 157084370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).