4-(4-bromophenyl)-2-[(3-fluoro-8-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid;4-(4-bromophenyl)-2-(imidazo[1,2-a]pyridine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-[2-(3-fluoro-5-methylimidazo[1,2-a]pyridin-2-yl)-2-oxoethyl]thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(2-imidazo[1,2-a]pyridin-2-yl-2-oxoethyl)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-6-carbonylamino)thiophene-3-carboxylic acid

C120H78Br2Cl4F2N14O18S6 — CID 158434803

About 4-(4-bromophenyl)-2-[(3-fluoro-8-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid;4-(4-bromophenyl)-2-(imidazo[1,2-a]pyridine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-[2-(3-fluoro-5-methylimidazo[1,2-a]pyridin-2-yl)-2-oxoethyl]thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(2-imidazo[1,2-a]pyridin-2-yl-2-oxoethyl)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-6-carbonylamino)thiophene-3-carboxylic acid

4-(4-bromophenyl)-2-[(3-fluoro-8-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid;4-(4-bromophenyl)-2-(imidazo[1,2-a]pyridine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-[2-(3-fluoro-5-methylimidazo[1,2-a]pyridin-2-yl)-2-oxoethyl]thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(2-imidazo[1,2-a]pyridin-2-yl-2-oxoethyl)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-6-carbonylamino)thiophene-3-carboxylic acid (PubChem CID 158434803) has the molecular formula C120H78Br2Cl4F2N14O18S6 and a molecular weight of 2536.04 g/mol. Its IUPAC name is 4-(4-bromophenyl)-2-[(3-fluoro-8-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid;4-(4-bromophenyl)-2-(imidazo[1,2-a]pyridine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-[2-(3-fluoro-5-methylimidazo[1,2-a]pyridin-2-yl)-2-oxoethyl]thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(2-imidazo[1,2-a]pyridin-2-yl-2-oxoethyl)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-6-carbonylamino)thiophene-3-carboxylic acid.

Molecular Properties

• Compound Name: 4-(4-bromophenyl)-2-[(3-fluoro-8-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid;4-(4-bromophenyl)-2-(imidazo[1,2-a]pyridine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-[2-(3-fluoro-5-methylimidazo[1,2-a]pyridin-2-yl)-2-oxoethyl]thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(2-imidazo[1,2-a]pyridin-2-yl-2-oxoethyl)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-6-carbonylamino)thiophene-3-carboxylic acid
• PubChem CID: 158434803
• Molecular Formula: C120H78Br2Cl4F2N14O18S6
• Molecular Weight: 2536.04 g/mol
• Exact Mass: 2530.10
• IUPAC Name: 4-(4-bromophenyl)-2-[(3-fluoro-8-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid;4-(4-bromophenyl)-2-(imidazo[1,2-a]pyridine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-[2-(3-fluoro-5-methylimidazo[1,2-a]pyridin-2-yl)-2-oxoethyl]thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(2-imidazo[1,2-a]pyridin-2-yl-2-oxoethyl)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-6-carbonylamino)thiophene-3-carboxylic acid
• SMILES: Cc1cccc2nc(C(=O)Cc3scc(-c4ccc(Cl)cc4)c3C(=O)O)c(F)n12.Cc1cccn2c(F)c(C(=O)Nc3scc(-c4ccc(Br)cc4)c3C(=O)O)nc12.O=C(Cc1scc(-c2ccc(Cl)cc2)c1C(=O)O)c1cn2ccccc2n1.O=C(Nc1scc(-c2ccc(Br)cc2)c1C(=O)O)c1cn2ccccc2n1.O=C(Nc1scc(-c2ccc(Cl)cc2)c1C(=O)O)c1cc2ccccn2c1.O=C(Nc1scc(-c2ccc(Cl)cc2)c1C(=O)O)c1ccc2cccn2c1
• InChI: InChI=1S/C21H14ClFN2O3S.C20H13BrFN3O3S.3C20H13ClN2O3S.C19H12BrN3O3S/c1-11-3-2-4-17-24-19(20(23)25(11)17)15(26)9-16-18(21(27)28)14(10-29-16)12-5-7-13(22)8-6-12;1-10-3-2-8-25-16(22)15(23-17(10)25)18(26)24-19-14(20(27)28)13(9-29-19)11-4-6-12(21)7-5-11;21-14-6-3-12(4-7-14)16-11-27-19(17(16)20(25)26)22-18(24)13-5-8-15-2-1-9-23(15)10-13;21-14-6-4-12(5-7-14)16-11-27-19(17(16)20(25)26)22-18(24)13-9-15-3-1-2-8-23(15)10-13;21-13-6-4-12(5-7-13)14-11-27-17(19(14)20(25)26)9-16(24)15-10-23-8-2-1-3-18(23)22-15;20-12-6-4-11(5-7-12)13-10-27-18(16(13)19(25)26)22-17(24)14-9-23-8-2-1-3-15(23)21-14/h2-8,10H,9H2,1H3,(H,27,28);2-9H,1H3,(H,24,26)(H,27,28);2*1-11H,(H,22,24)(H,25,26);1-8,10-11H,9H2,(H,25,26);1-10H,(H,22,24)(H,25,26)
• InChIKey: HCCCVIBZSPDEOV-UHFFFAOYSA-N
• XLogP: 30.67
• TPSA: 452.36 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 28
• Rotatable Bonds: 26
• Heavy Atoms: 166
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2536.04
LogP ≤ 5	30.67
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'thiophene_amino_Ab(40)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-(4-bromophenyl)-2-[(3-fluoro-8-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid;4-(4-bromophenyl)-2-(imidazo[1,2-a]pyridine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-[2-(3-fluoro-5-methylimidazo[1,2-a]pyridin-2-yl)-2-oxoethyl]thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(2-imidazo[1,2-a]pyridin-2-yl-2-oxoethyl)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-6-carbonylamino)thiophene-3-carboxylic acid?

The IUPAC name of 4-(4-bromophenyl)-2-[(3-fluoro-8-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid;4-(4-bromophenyl)-2-(imidazo[1,2-a]pyridine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-[2-(3-fluoro-5-methylimidazo[1,2-a]pyridin-2-yl)-2-oxoethyl]thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(2-imidazo[1,2-a]pyridin-2-yl-2-oxoethyl)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-6-carbonylamino)thiophene-3-carboxylic acid (CID 158434803) is 4-(4-bromophenyl)-2-[(3-fluoro-8-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid;4-(4-bromophenyl)-2-(imidazo[1,2-a]pyridine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-[2-(3-fluoro-5-methylimidazo[1,2-a]pyridin-2-yl)-2-oxoethyl]thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(2-imidazo[1,2-a]pyridin-2-yl-2-oxoethyl)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-6-carbonylamino)thiophene-3-carboxylic acid.

What is the SMILES notation for 4-(4-bromophenyl)-2-[(3-fluoro-8-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid;4-(4-bromophenyl)-2-(imidazo[1,2-a]pyridine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-[2-(3-fluoro-5-methylimidazo[1,2-a]pyridin-2-yl)-2-oxoethyl]thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(2-imidazo[1,2-a]pyridin-2-yl-2-oxoethyl)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-6-carbonylamino)thiophene-3-carboxylic acid?

The canonical SMILES for 4-(4-bromophenyl)-2-[(3-fluoro-8-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid;4-(4-bromophenyl)-2-(imidazo[1,2-a]pyridine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-[2-(3-fluoro-5-methylimidazo[1,2-a]pyridin-2-yl)-2-oxoethyl]thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(2-imidazo[1,2-a]pyridin-2-yl-2-oxoethyl)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-6-carbonylamino)thiophene-3-carboxylic acid is Cc1cccc2nc(C(=O)Cc3scc(-c4ccc(Cl)cc4)c3C(=O)O)c(F)n12.Cc1cccn2c(F)c(C(=O)Nc3scc(-c4ccc(Br)cc4)c3C(=O)O)nc12.O=C(Cc1scc(-c2ccc(Cl)cc2)c1C(=O)O)c1cn2ccccc2n1.O=C(Nc1scc(-c2ccc(Br)cc2)c1C(=O)O)c1cn2ccccc2n1.O=C(Nc1scc(-c2ccc(Cl)cc2)c1C(=O)O)c1cc2ccccn2c1.O=C(Nc1scc(-c2ccc(Cl)cc2)c1C(=O)O)c1ccc2cccn2c1.

What is the InChIKey of 4-(4-bromophenyl)-2-[(3-fluoro-8-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid;4-(4-bromophenyl)-2-(imidazo[1,2-a]pyridine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-[2-(3-fluoro-5-methylimidazo[1,2-a]pyridin-2-yl)-2-oxoethyl]thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(2-imidazo[1,2-a]pyridin-2-yl-2-oxoethyl)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-6-carbonylamino)thiophene-3-carboxylic acid?

The InChIKey is HCCCVIBZSPDEOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14ClFN2O3S.C20H13BrFN3O3S.3C20H13ClN2O3S.C19H12BrN3O3S/c1-11-3-2-4-17-24-19(20(23)25(11)17)15(26)9-16-18(21(27)28)14(10-29-16)12-5-7-13(22)8-6-12;1-10-3-2-8-25-16(22)15(23-17(10)25)18(26)24-19-14(20(27)28)13(9-29-19)11-4-6-12(21)7-5-11;21-14-6-3-12(4-7-14)16-11-27-19(17(16)20(25)26)22-18(24)13-5-8-15-2-1-9-23(15)10-13;21-14-6-4-12(5-7-14)16-11-27-19(17(16)20(25)26)22-18(24)13-9-15-3-1-2-8-23(15)10-13;21-13-6-4-12(5-7-13)14-11-27-17(19(14)20(25)26)9-16(24)15-10-23-8-2-1-3-18(23)22-15;20-12-6-4-11(5-7-12)13-10-27-18(16(13)19(25)26)22-17(24)14-9-23-8-2-1-3-15(23)21-14/h2-8,10H,9H2,1H3,(H,27,28);2-9H,1H3,(H,24,26)(H,27,28);2*1-11H,(H,22,24)(H,25,26);1-8,10-11H,9H2,(H,25,26);1-10H,(H,22,24)(H,25,26).

What are the key properties of 4-(4-bromophenyl)-2-[(3-fluoro-8-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid;4-(4-bromophenyl)-2-(imidazo[1,2-a]pyridine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-[2-(3-fluoro-5-methylimidazo[1,2-a]pyridin-2-yl)-2-oxoethyl]thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(2-imidazo[1,2-a]pyridin-2-yl-2-oxoethyl)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-6-carbonylamino)thiophene-3-carboxylic acid?

4-(4-bromophenyl)-2-[(3-fluoro-8-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid;4-(4-bromophenyl)-2-(imidazo[1,2-a]pyridine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-[2-(3-fluoro-5-methylimidazo[1,2-a]pyridin-2-yl)-2-oxoethyl]thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(2-imidazo[1,2-a]pyridin-2-yl-2-oxoethyl)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-6-carbonylamino)thiophene-3-carboxylic acid has a molecular weight of 2536.04 g/mol, XLogP of 30.67, 26 rotatable bonds, 10 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(4-bromophenyl)-2-[(3-fluoro-8-methylimidazo[1,2-a]pyridine-2-carbonyl)amino]thiophene-3-carboxylic acid;4-(4-bromophenyl)-2-(imidazo[1,2-a]pyridine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-[2-(3-fluoro-5-methylimidazo[1,2-a]pyridin-2-yl)-2-oxoethyl]thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(2-imidazo[1,2-a]pyridin-2-yl-2-oxoethyl)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-2-carbonylamino)thiophene-3-carboxylic acid;4-(4-chlorophenyl)-2-(indolizine-6-carbonylamino)thiophene-3-carboxylic acid is sourced from PubChem (CID 158434803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).