bis(carbon dioxide);N-chloro-1-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;[2-[[4-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methylcarbamoyl]triazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methyl formate;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxamide;1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid

C76H69Cl4F3N24O10 — CID 158267001

About bis(carbon dioxide);N-chloro-1-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;[2-[[4-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methylcarbamoyl]triazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methyl formate;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxamide;1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid

bis(carbon dioxide);N-chloro-1-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;[2-[[4-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methylcarbamoyl]triazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methyl formate;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxamide;1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid (PubChem CID 158267001) has the molecular formula C76H69Cl4F3N24O10 and a molecular weight of 1677.35 g/mol. Its IUPAC name is bis(carbon dioxide);N-chloro-1-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;[2-[[4-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methylcarbamoyl]triazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methyl formate;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxamide;1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid.

Molecular Properties

• Compound Name: bis(carbon dioxide);N-chloro-1-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;[2-[[4-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methylcarbamoyl]triazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methyl formate;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxamide;1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid
• PubChem CID: 158267001
• Molecular Formula: C76H69Cl4F3N24O10
• Molecular Weight: 1677.35 g/mol
• Exact Mass: 1674.43
• IUPAC Name: bis(carbon dioxide);N-chloro-1-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;[2-[[4-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methylcarbamoyl]triazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methyl formate;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxamide;1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid
• SMILES: CCCc1cc(C2CC2)cn2cc(Cn3cc(C(=O)NCc4ncn5ccc(Cl)c(F)c45)nn3)nc12.CCCc1cc(C2CC2)cn2cc(Cn3cc(C(=O)O)nn3)nc12.Fc1c(Cl)ccn2cnc(CNCl)c12.O=C=O.O=C=O.O=COCc1cc(C2CC2)cn2cc(Cn3cc(C(=O)NCc4ncn5ccc(Cl)c(F)c45)nn3)nc12
• InChI: InChI=1S/C25H24ClFN8O.C24H20ClFN8O3.C17H19N5O2.C8H6Cl2FN3.2CO2/c1-2-3-16-8-17(15-4-5-15)10-34-11-18(30-24(16)34)12-35-13-21(31-32-35)25(36)28-9-20-23-22(27)19(26)6-7-33(23)14-29-20;25-18-3-4-32-12-28-19(22(32)21(18)26)6-27-24(36)20-10-34(31-30-20)9-17-8-33-7-15(14-1-2-14)5-16(11-37-13-35)23(33)29-17;1-2-3-12-6-13(11-4-5-11)7-21-8-14(18-16(12)21)9-22-10-15(17(23)24)19-20-22;9-5-1-2-14-4-12-6(3-13-10)8(14)7(5)11;2*2-1-3/h6-8,10-11,13-15H,2-5,9,12H2,1H3,(H,28,36);3-5,7-8,10,12-14H,1-2,6,9,11H2,(H,27,36);6-8,10-11H,2-5,9H2,1H3,(H,23,24);1-2,4,13H,3H2
• InChIKey: GIOOFDADDQHRAZ-UHFFFAOYSA-N
• XLogP: 10.77
• TPSA: 398.04 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 31
• Rotatable Bonds: 25
• Heavy Atoms: 117
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1677.35
LogP ≤ 5	10.77
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'N-halo', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of bis(carbon dioxide);N-chloro-1-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;[2-[[4-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methylcarbamoyl]triazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methyl formate;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxamide;1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid?

The IUPAC name of bis(carbon dioxide);N-chloro-1-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;[2-[[4-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methylcarbamoyl]triazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methyl formate;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxamide;1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid (CID 158267001) is bis(carbon dioxide);N-chloro-1-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;[2-[[4-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methylcarbamoyl]triazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methyl formate;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxamide;1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid.

What is the SMILES notation for bis(carbon dioxide);N-chloro-1-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;[2-[[4-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methylcarbamoyl]triazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methyl formate;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxamide;1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid?

The canonical SMILES for bis(carbon dioxide);N-chloro-1-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;[2-[[4-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methylcarbamoyl]triazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methyl formate;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxamide;1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid is CCCc1cc(C2CC2)cn2cc(Cn3cc(C(=O)NCc4ncn5ccc(Cl)c(F)c45)nn3)nc12.CCCc1cc(C2CC2)cn2cc(Cn3cc(C(=O)O)nn3)nc12.Fc1c(Cl)ccn2cnc(CNCl)c12.O=C=O.O=C=O.O=COCc1cc(C2CC2)cn2cc(Cn3cc(C(=O)NCc4ncn5ccc(Cl)c(F)c45)nn3)nc12.

What is the InChIKey of bis(carbon dioxide);N-chloro-1-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;[2-[[4-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methylcarbamoyl]triazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methyl formate;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxamide;1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid?

The InChIKey is GIOOFDADDQHRAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24ClFN8O.C24H20ClFN8O3.C17H19N5O2.C8H6Cl2FN3.2CO2/c1-2-3-16-8-17(15-4-5-15)10-34-11-18(30-24(16)34)12-35-13-21(31-32-35)25(36)28-9-20-23-22(27)19(26)6-7-33(23)14-29-20;25-18-3-4-32-12-28-19(22(32)21(18)26)6-27-24(36)20-10-34(31-30-20)9-17-8-33-7-15(14-1-2-14)5-16(11-37-13-35)23(33)29-17;1-2-3-12-6-13(11-4-5-11)7-21-8-14(18-16(12)21)9-22-10-15(17(23)24)19-20-22;9-5-1-2-14-4-12-6(3-13-10)8(14)7(5)11;2*2-1-3/h6-8,10-11,13-15H,2-5,9,12H2,1H3,(H,28,36);3-5,7-8,10,12-14H,1-2,6,9,11H2,(H,27,36);6-8,10-11H,2-5,9H2,1H3,(H,23,24);1-2,4,13H,3H2;;.

What are the key properties of bis(carbon dioxide);N-chloro-1-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;[2-[[4-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methylcarbamoyl]triazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methyl formate;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxamide;1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid?

bis(carbon dioxide);N-chloro-1-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;[2-[[4-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methylcarbamoyl]triazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methyl formate;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxamide;1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid has a molecular weight of 1677.35 g/mol, XLogP of 10.77, 25 rotatable bonds, 4 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for bis(carbon dioxide);N-chloro-1-(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methanamine;[2-[[4-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methylcarbamoyl]triazol-1-yl]methyl]-6-cyclopropylimidazo[1,2-a]pyridin-8-yl]methyl formate;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxamide;1-[(6-cyclopropyl-8-propylimidazo[1,2-a]pyridin-2-yl)methyl]triazole-4-carboxylic acid is sourced from PubChem (CID 158267001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).