7-bromo-6-chloro-3-piperidin-1-ylimidazo[1,2-a]pyridine;4-bromo-5-chloropyridin-2-amine;tert-butyl 4-[1,2-bis(benzotriazol-1-yl)-2-piperidin-1-ylethyl]piperazine-1-carboxylate;1-[4-[6-chloro-7-(5-methyl-1H-indazol-4-yl)imidazo[1,2-a]pyridin-3-yl]piperazin-1-yl]prop-2-en-1-one;bis(6-chloro-7-(5-methyl-1H-indazol-4-yl)-3-piperidin-1-ylimidazo[1,2-a]pyridine);(5-methyl-1H-indazol-4-yl)boronic acid;prop-2-enoyl chloride

C118H127BBr2Cl6N32O6 — CID 159082642

About 7-bromo-6-chloro-3-piperidin-1-ylimidazo[1,2-a]pyridine;4-bromo-5-chloropyridin-2-amine;tert-butyl 4-[1,2-bis(benzotriazol-1-yl)-2-piperidin-1-ylethyl]piperazine-1-carboxylate;1-[4-[6-chloro-7-(5-methyl-1H-indazol-4-yl)imidazo[1,2-a]pyridin-3-yl]piperazin-1-yl]prop-2-en-1-one;bis(6-chloro-7-(5-methyl-1H-indazol-4-yl)-3-piperidin-1-ylimidazo[1,2-a]pyridine);(5-methyl-1H-indazol-4-yl)boronic acid;prop-2-enoyl chloride

7-bromo-6-chloro-3-piperidin-1-ylimidazo[1,2-a]pyridine;4-bromo-5-chloropyridin-2-amine;tert-butyl 4-[1,2-bis(benzotriazol-1-yl)-2-piperidin-1-ylethyl]piperazine-1-carboxylate;1-[4-[6-chloro-7-(5-methyl-1H-indazol-4-yl)imidazo[1,2-a]pyridin-3-yl]piperazin-1-yl]prop-2-en-1-one;bis(6-chloro-7-(5-methyl-1H-indazol-4-yl)-3-piperidin-1-ylimidazo[1,2-a]pyridine);(5-methyl-1H-indazol-4-yl)boronic acid;prop-2-enoyl chloride (PubChem CID 159082642) has the molecular formula C118H127BBr2Cl6N32O6 and a molecular weight of 2472.87 g/mol. Its IUPAC name is 7-bromo-6-chloro-3-piperidin-1-ylimidazo[1,2-a]pyridine;4-bromo-5-chloropyridin-2-amine;tert-butyl 4-[1,2-bis(benzotriazol-1-yl)-2-piperidin-1-ylethyl]piperazine-1-carboxylate;1-[4-[6-chloro-7-(5-methyl-1H-indazol-4-yl)imidazo[1,2-a]pyridin-3-yl]piperazin-1-yl]prop-2-en-1-one;bis(6-chloro-7-(5-methyl-1H-indazol-4-yl)-3-piperidin-1-ylimidazo[1,2-a]pyridine);(5-methyl-1H-indazol-4-yl)boronic acid;prop-2-enoyl chloride.

Molecular Properties

• Compound Name: 7-bromo-6-chloro-3-piperidin-1-ylimidazo[1,2-a]pyridine;4-bromo-5-chloropyridin-2-amine;tert-butyl 4-[1,2-bis(benzotriazol-1-yl)-2-piperidin-1-ylethyl]piperazine-1-carboxylate;1-[4-[6-chloro-7-(5-methyl-1H-indazol-4-yl)imidazo[1,2-a]pyridin-3-yl]piperazin-1-yl]prop-2-en-1-one;bis(6-chloro-7-(5-methyl-1H-indazol-4-yl)-3-piperidin-1-ylimidazo[1,2-a]pyridine);(5-methyl-1H-indazol-4-yl)boronic acid;prop-2-enoyl chloride
• PubChem CID: 159082642
• Molecular Formula: C118H127BBr2Cl6N32O6
• Molecular Weight: 2472.87 g/mol
• Exact Mass: 2466.72
• IUPAC Name: 7-bromo-6-chloro-3-piperidin-1-ylimidazo[1,2-a]pyridine;4-bromo-5-chloropyridin-2-amine;tert-butyl 4-[1,2-bis(benzotriazol-1-yl)-2-piperidin-1-ylethyl]piperazine-1-carboxylate;1-[4-[6-chloro-7-(5-methyl-1H-indazol-4-yl)imidazo[1,2-a]pyridin-3-yl]piperazin-1-yl]prop-2-en-1-one;bis(6-chloro-7-(5-methyl-1H-indazol-4-yl)-3-piperidin-1-ylimidazo[1,2-a]pyridine);(5-methyl-1H-indazol-4-yl)boronic acid;prop-2-enoyl chloride
• SMILES: C=CC(=O)Cl.C=CC(=O)N1CCN(c2cnc3cc(-c4c(C)ccc5[nH]ncc45)c(Cl)cn23)CC1.CC(C)(C)OC(=O)N1CCN(C(C(N2CCCCC2)n2nnc3ccccc32)n2nnc3ccccc32)CC1.Cc1ccc2[nH]ncc2c1-c1cc2ncc(N3CCCCC3)n2cc1Cl.Cc1ccc2[nH]ncc2c1-c1cc2ncc(N3CCCCC3)n2cc1Cl.Cc1ccc2[nH]ncc2c1B(O)O.Clc1cn2c(N3CCCCC3)cnc2cc1Br.Nc1cc(Br)c(Cl)cn1
• InChI: InChI=1S/C28H37N9O2.C22H21ClN6O.2C20H20ClN5.C12H13BrClN3.C8H9BN2O2.C5H4BrClN2.C3H3ClO/c1-28(2,3)39-27(38)35-19-17-34(18-20-35)26(37-24-14-8-6-12-22(24)30-32-37)25(33-15-9-4-10-16-33)36-23-13-7-5-11-21(23)29-31-36;1-3-21(30)28-8-6-27(7-9-28)20-12-24-19-10-15(17(23)13-29(19)20)22-14(2)4-5-18-16(22)11-25-26-18;2*1-13-5-6-17-15(10-23-24-17)20(13)14-9-18-22-11-19(26(18)12-16(14)21)25-7-3-2-4-8-25;13-9-6-11-15-7-12(17(11)8-10(9)14)16-4-2-1-3-5-16;1-5-2-3-7-6(4-10-11-7)8(5)9(12)13;6-3-1-5(8)9-2-4(3)7;1-2-3(4)5/h5-8,11-14,25-26H,4,9-10,15-20H2,1-3H3;3-5,10-13H,1,6-9H2,2H3,(H,25,26);2*5-6,9-12H,2-4,7-8H2,1H3,(H,23,24);6-8H,1-5H2;2-4,12-13H,1H3,(H,10,11);1-2H,(H2,8,9);2H,1H2
• InChIKey: KBAYKJLZRJGGBN-UHFFFAOYSA-N
• XLogP: 23.55
• TPSA: 411.07 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 32
• Rotatable Bonds: 15
• Heavy Atoms: 165
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2472.87
LogP ≤ 5	23.55
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acid_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 7-bromo-6-chloro-3-piperidin-1-ylimidazo[1,2-a]pyridine;4-bromo-5-chloropyridin-2-amine;tert-butyl 4-[1,2-bis(benzotriazol-1-yl)-2-piperidin-1-ylethyl]piperazine-1-carboxylate;1-[4-[6-chloro-7-(5-methyl-1H-indazol-4-yl)imidazo[1,2-a]pyridin-3-yl]piperazin-1-yl]prop-2-en-1-one;bis(6-chloro-7-(5-methyl-1H-indazol-4-yl)-3-piperidin-1-ylimidazo[1,2-a]pyridine);(5-methyl-1H-indazol-4-yl)boronic acid;prop-2-enoyl chloride?

The IUPAC name of 7-bromo-6-chloro-3-piperidin-1-ylimidazo[1,2-a]pyridine;4-bromo-5-chloropyridin-2-amine;tert-butyl 4-[1,2-bis(benzotriazol-1-yl)-2-piperidin-1-ylethyl]piperazine-1-carboxylate;1-[4-[6-chloro-7-(5-methyl-1H-indazol-4-yl)imidazo[1,2-a]pyridin-3-yl]piperazin-1-yl]prop-2-en-1-one;bis(6-chloro-7-(5-methyl-1H-indazol-4-yl)-3-piperidin-1-ylimidazo[1,2-a]pyridine);(5-methyl-1H-indazol-4-yl)boronic acid;prop-2-enoyl chloride (CID 159082642) is 7-bromo-6-chloro-3-piperidin-1-ylimidazo[1,2-a]pyridine;4-bromo-5-chloropyridin-2-amine;tert-butyl 4-[1,2-bis(benzotriazol-1-yl)-2-piperidin-1-ylethyl]piperazine-1-carboxylate;1-[4-[6-chloro-7-(5-methyl-1H-indazol-4-yl)imidazo[1,2-a]pyridin-3-yl]piperazin-1-yl]prop-2-en-1-one;bis(6-chloro-7-(5-methyl-1H-indazol-4-yl)-3-piperidin-1-ylimidazo[1,2-a]pyridine);(5-methyl-1H-indazol-4-yl)boronic acid;prop-2-enoyl chloride.

What is the SMILES notation for 7-bromo-6-chloro-3-piperidin-1-ylimidazo[1,2-a]pyridine;4-bromo-5-chloropyridin-2-amine;tert-butyl 4-[1,2-bis(benzotriazol-1-yl)-2-piperidin-1-ylethyl]piperazine-1-carboxylate;1-[4-[6-chloro-7-(5-methyl-1H-indazol-4-yl)imidazo[1,2-a]pyridin-3-yl]piperazin-1-yl]prop-2-en-1-one;bis(6-chloro-7-(5-methyl-1H-indazol-4-yl)-3-piperidin-1-ylimidazo[1,2-a]pyridine);(5-methyl-1H-indazol-4-yl)boronic acid;prop-2-enoyl chloride?

The canonical SMILES for 7-bromo-6-chloro-3-piperidin-1-ylimidazo[1,2-a]pyridine;4-bromo-5-chloropyridin-2-amine;tert-butyl 4-[1,2-bis(benzotriazol-1-yl)-2-piperidin-1-ylethyl]piperazine-1-carboxylate;1-[4-[6-chloro-7-(5-methyl-1H-indazol-4-yl)imidazo[1,2-a]pyridin-3-yl]piperazin-1-yl]prop-2-en-1-one;bis(6-chloro-7-(5-methyl-1H-indazol-4-yl)-3-piperidin-1-ylimidazo[1,2-a]pyridine);(5-methyl-1H-indazol-4-yl)boronic acid;prop-2-enoyl chloride is C=CC(=O)Cl.C=CC(=O)N1CCN(c2cnc3cc(-c4c(C)ccc5[nH]ncc45)c(Cl)cn23)CC1.CC(C)(C)OC(=O)N1CCN(C(C(N2CCCCC2)n2nnc3ccccc32)n2nnc3ccccc32)CC1.Cc1ccc2[nH]ncc2c1-c1cc2ncc(N3CCCCC3)n2cc1Cl.Cc1ccc2[nH]ncc2c1-c1cc2ncc(N3CCCCC3)n2cc1Cl.Cc1ccc2[nH]ncc2c1B(O)O.Clc1cn2c(N3CCCCC3)cnc2cc1Br.Nc1cc(Br)c(Cl)cn1.

What is the InChIKey of 7-bromo-6-chloro-3-piperidin-1-ylimidazo[1,2-a]pyridine;4-bromo-5-chloropyridin-2-amine;tert-butyl 4-[1,2-bis(benzotriazol-1-yl)-2-piperidin-1-ylethyl]piperazine-1-carboxylate;1-[4-[6-chloro-7-(5-methyl-1H-indazol-4-yl)imidazo[1,2-a]pyridin-3-yl]piperazin-1-yl]prop-2-en-1-one;bis(6-chloro-7-(5-methyl-1H-indazol-4-yl)-3-piperidin-1-ylimidazo[1,2-a]pyridine);(5-methyl-1H-indazol-4-yl)boronic acid;prop-2-enoyl chloride?

The InChIKey is KBAYKJLZRJGGBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H37N9O2.C22H21ClN6O.2C20H20ClN5.C12H13BrClN3.C8H9BN2O2.C5H4BrClN2.C3H3ClO/c1-28(2,3)39-27(38)35-19-17-34(18-20-35)26(37-24-14-8-6-12-22(24)30-32-37)25(33-15-9-4-10-16-33)36-23-13-7-5-11-21(23)29-31-36;1-3-21(30)28-8-6-27(7-9-28)20-12-24-19-10-15(17(23)13-29(19)20)22-14(2)4-5-18-16(22)11-25-26-18;2*1-13-5-6-17-15(10-23-24-17)20(13)14-9-18-22-11-19(26(18)12-16(14)21)25-7-3-2-4-8-25;13-9-6-11-15-7-12(17(11)8-10(9)14)16-4-2-1-3-5-16;1-5-2-3-7-6(4-10-11-7)8(5)9(12)13;6-3-1-5(8)9-2-4(3)7;1-2-3(4)5/h5-8,11-14,25-26H,4,9-10,15-20H2,1-3H3;3-5,10-13H,1,6-9H2,2H3,(H,25,26);2*5-6,9-12H,2-4,7-8H2,1H3,(H,23,24);6-8H,1-5H2;2-4,12-13H,1H3,(H,10,11);1-2H,(H2,8,9);2H,1H2.

What are the key properties of 7-bromo-6-chloro-3-piperidin-1-ylimidazo[1,2-a]pyridine;4-bromo-5-chloropyridin-2-amine;tert-butyl 4-[1,2-bis(benzotriazol-1-yl)-2-piperidin-1-ylethyl]piperazine-1-carboxylate;1-[4-[6-chloro-7-(5-methyl-1H-indazol-4-yl)imidazo[1,2-a]pyridin-3-yl]piperazin-1-yl]prop-2-en-1-one;bis(6-chloro-7-(5-methyl-1H-indazol-4-yl)-3-piperidin-1-ylimidazo[1,2-a]pyridine);(5-methyl-1H-indazol-4-yl)boronic acid;prop-2-enoyl chloride?

7-bromo-6-chloro-3-piperidin-1-ylimidazo[1,2-a]pyridine;4-bromo-5-chloropyridin-2-amine;tert-butyl 4-[1,2-bis(benzotriazol-1-yl)-2-piperidin-1-ylethyl]piperazine-1-carboxylate;1-[4-[6-chloro-7-(5-methyl-1H-indazol-4-yl)imidazo[1,2-a]pyridin-3-yl]piperazin-1-yl]prop-2-en-1-one;bis(6-chloro-7-(5-methyl-1H-indazol-4-yl)-3-piperidin-1-ylimidazo[1,2-a]pyridine);(5-methyl-1H-indazol-4-yl)boronic acid;prop-2-enoyl chloride has a molecular weight of 2472.87 g/mol, XLogP of 23.55, 15 rotatable bonds, 7 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 7-bromo-6-chloro-3-piperidin-1-ylimidazo[1,2-a]pyridine;4-bromo-5-chloropyridin-2-amine;tert-butyl 4-[1,2-bis(benzotriazol-1-yl)-2-piperidin-1-ylethyl]piperazine-1-carboxylate;1-[4-[6-chloro-7-(5-methyl-1H-indazol-4-yl)imidazo[1,2-a]pyridin-3-yl]piperazin-1-yl]prop-2-en-1-one;bis(6-chloro-7-(5-methyl-1H-indazol-4-yl)-3-piperidin-1-ylimidazo[1,2-a]pyridine);(5-methyl-1H-indazol-4-yl)boronic acid;prop-2-enoyl chloride is sourced from PubChem (CID 159082642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).