tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl 1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;2-methyl-1,3-thiazole;tributyl-(2-methyl-1,3-thiazol-5-yl)stannane;hydrochloride

C112H125BrCl3F2N31O7S5Sn — CID 157492229

About tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl 1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;2-methyl-1,3-thiazole;tributyl-(2-methyl-1,3-thiazol-5-yl)stannane;hydrochloride

tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl 1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;2-methyl-1,3-thiazole;tributyl-(2-methyl-1,3-thiazol-5-yl)stannane;hydrochloride (PubChem CID 157492229) has the molecular formula C112H125BrCl3F2N31O7S5Sn and a molecular weight of 2520.75 g/mol. Its IUPAC name is tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl 1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;2-methyl-1,3-thiazole;tributyl-(2-methyl-1,3-thiazol-5-yl)stannane;hydrochloride.

Molecular Properties

• Compound Name: tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl 1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;2-methyl-1,3-thiazole;tributyl-(2-methyl-1,3-thiazol-5-yl)stannane;hydrochloride
• PubChem CID: 157492229
• Molecular Formula: C112H125BrCl3F2N31O7S5Sn
• Molecular Weight: 2520.75 g/mol
• Exact Mass: 2517.62
• IUPAC Name: tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl 1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;2-methyl-1,3-thiazole;tributyl-(2-methyl-1,3-thiazol-5-yl)stannane;hydrochloride
• SMILES: CC(C)(C)OC(=O)c1cn(Cc2cn3cc(C4CC4)cc(Br)c3n2)nn1.CCCC[Sn](CCCC)(CCCC)c1cnc(C)s1.Cc1ncc(-c2cc(C3CC3)cn3cc(Cn4cc(C(=O)NCc5ncn6ccc(Cl)c(F)c56)nn4)nc23)s1.Cc1ncc(-c2cc(C3CC3)cn3cc(Cn4cc(C(=O)O)nn4)nc23)s1.Cc1ncc(-c2cc(C3CC3)cn3cc(Cn4cc(C(=O)OC(C)(C)C)nn4)nc23)s1.Cc1nccs1.Cl.NCc1ncn2ccc(Cl)c(F)c12
• InChI: InChI=1S/C26H21ClFN9OS.C22H24N6O2S.C18H20BrN5O2.C18H16N6O2S.C8H7ClFN3.C4H5NS.C4H4NS.3C4H9.ClH.Sn/c1-14-29-8-22(39-14)18-6-16(15-2-3-15)9-36-10-17(32-25(18)36)11-37-12-21(33-34-37)26(38)30-7-20-24-23(28)19(27)4-5-35(24)13-31-20;1-13-23-8-19(31-13)17-7-15(14-5-6-14)9-27-10-16(24-20(17)27)11-28-12-18(25-26-28)21(29)30-22(2,3)4;1-18(2,3)26-17(25)15-10-24(22-21-15)9-13-8-23-7-12(11-4-5-11)6-14(19)16(23)20-13;1-10-19-5-16(27-10)14-4-12(11-2-3-11)6-23-7-13(20-17(14)23)8-24-9-15(18(25)26)21-22-24;9-5-1-2-13-4-12-6(3-11)8(13)7(5)10;2*1-4-5-2-3-6-4;3*1-3-4-2;;/h4-6,8-10,12-13,15H,2-3,7,11H2,1H3,(H,30,38);7-10,12,14H,5-6,11H2,1-4H3;6-8,10-11H,4-5,9H2,1-3H3;4-7,9,11H,2-3,8H2,1H3,(H,25,26);1-2,4H,3,11H2;2-3H,1H3;2H,1H3;3*1,3-4H2,2H3;1H
• InChIKey: NGRIZNBZLVXGRL-UHFFFAOYSA-N
• XLogP: 24.41
• TPSA: 436.11 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 41
• Rotatable Bonds: 32
• Heavy Atoms: 162
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2520.75
LogP ≤ 5	24.41
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	41

Frequently Asked Questions

What is the IUPAC name of tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl 1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;2-methyl-1,3-thiazole;tributyl-(2-methyl-1,3-thiazol-5-yl)stannane;hydrochloride?

The IUPAC name of tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl 1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;2-methyl-1,3-thiazole;tributyl-(2-methyl-1,3-thiazol-5-yl)stannane;hydrochloride (CID 157492229) is tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl 1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;2-methyl-1,3-thiazole;tributyl-(2-methyl-1,3-thiazol-5-yl)stannane;hydrochloride.

What is the SMILES notation for tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl 1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;2-methyl-1,3-thiazole;tributyl-(2-methyl-1,3-thiazol-5-yl)stannane;hydrochloride?

The canonical SMILES for tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl 1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;2-methyl-1,3-thiazole;tributyl-(2-methyl-1,3-thiazol-5-yl)stannane;hydrochloride is CC(C)(C)OC(=O)c1cn(Cc2cn3cc(C4CC4)cc(Br)c3n2)nn1.CCCC[Sn](CCCC)(CCCC)c1cnc(C)s1.Cc1ncc(-c2cc(C3CC3)cn3cc(Cn4cc(C(=O)NCc5ncn6ccc(Cl)c(F)c56)nn4)nc23)s1.Cc1ncc(-c2cc(C3CC3)cn3cc(Cn4cc(C(=O)O)nn4)nc23)s1.Cc1ncc(-c2cc(C3CC3)cn3cc(Cn4cc(C(=O)OC(C)(C)C)nn4)nc23)s1.Cc1nccs1.Cl.NCc1ncn2ccc(Cl)c(F)c12.

What is the InChIKey of tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl 1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;2-methyl-1,3-thiazole;tributyl-(2-methyl-1,3-thiazol-5-yl)stannane;hydrochloride?

The InChIKey is NGRIZNBZLVXGRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H21ClFN9OS.C22H24N6O2S.C18H20BrN5O2.C18H16N6O2S.C8H7ClFN3.C4H5NS.C4H4NS.3C4H9.ClH.Sn/c1-14-29-8-22(39-14)18-6-16(15-2-3-15)9-36-10-17(32-25(18)36)11-37-12-21(33-34-37)26(38)30-7-20-24-23(28)19(27)4-5-35(24)13-31-20;1-13-23-8-19(31-13)17-7-15(14-5-6-14)9-27-10-16(24-20(17)27)11-28-12-18(25-26-28)21(29)30-22(2,3)4;1-18(2,3)26-17(25)15-10-24(22-21-15)9-13-8-23-7-12(11-4-5-11)6-14(19)16(23)20-13;1-10-19-5-16(27-10)14-4-12(11-2-3-11)6-23-7-13(20-17(14)23)8-24-9-15(18(25)26)21-22-24;9-5-1-2-13-4-12-6(3-11)8(13)7(5)10;2*1-4-5-2-3-6-4;3*1-3-4-2;;/h4-6,8-10,12-13,15H,2-3,7,11H2,1H3,(H,30,38);7-10,12,14H,5-6,11H2,1-4H3;6-8,10-11H,4-5,9H2,1-3H3;4-7,9,11H,2-3,8H2,1H3,(H,25,26);1-2,4H,3,11H2;2-3H,1H3;2H,1H3;3*1,3-4H2,2H3;1H;.

What are the key properties of tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl 1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;2-methyl-1,3-thiazole;tributyl-(2-methyl-1,3-thiazol-5-yl)stannane;hydrochloride?

tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl 1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;2-methyl-1,3-thiazole;tributyl-(2-methyl-1,3-thiazol-5-yl)stannane;hydrochloride has a molecular weight of 2520.75 g/mol, XLogP of 24.41, 32 rotatable bonds, 3 hydrogen bond donors, and 41 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl 1-[(8-bromo-6-cyclopropylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylate;tert-butyl 1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylate;(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxamide;1-[[6-cyclopropyl-8-(2-methyl-1,3-thiazol-5-yl)imidazo[1,2-a]pyridin-2-yl]methyl]triazole-4-carboxylic acid;2-methyl-1,3-thiazole;tributyl-(2-methyl-1,3-thiazol-5-yl)stannane;hydrochloride is sourced from PubChem (CID 157492229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).