3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1H-indazole;3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1-methylindazole;3-(1H-benzimidazol-2-yl)-1-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-chloro-3-iodopyridine

About 3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1H-indazole;3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1-methylindazole;3-(1H-benzimidazol-2-yl)-1-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-chloro-3-iodopyridine

3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1H-indazole;3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1-methylindazole;3-(1H-benzimidazol-2-yl)-1-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-chloro-3-iodopyridine (PubChem CID 160937220) has the molecular formula C65H52BCl3IN15O2 and a molecular weight of 1319.31 g/mol. Its IUPAC name is 3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1H-indazole;3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1-methylindazole;3-(1H-benzimidazol-2-yl)-1-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-chloro-3-iodopyridine.

Molecular Properties

Compound Name	3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1H-indazole;3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1-methylindazole;3-(1H-benzimidazol-2-yl)-1-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-chloro-3-iodopyridine
PubChem CID	160937220
Molecular Formula	C65H52BCl3IN15O2
Molecular Weight	1319.31 g/mol
Exact Mass	1317.26
IUPAC Name	3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1H-indazole;3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1-methylindazole;3-(1H-benzimidazol-2-yl)-1-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-chloro-3-iodopyridine
SMILES	Clc1ccncc1-c1ccc2[nH]nc(-c3nc4ccccc4[nH]3)c2c1.Clc1ccncc1I.Cn1nc(-c2nc3ccccc3[nH]2)c2cc(-c3cnccc3Cl)ccc21.Cn1nc(-c2nc3ccccc3[nH]2)c2cc(B3OC(C)(C)C(C)(C)O3)ccc21
InChI	InChI=1S/C21H23BN4O2.C20H14ClN5.C19H12ClN5.C5H3ClIN/c1-20(2)21(3,4)28-22(27-20)13-10-11-17-14(12-13)18(25-26(17)5)19-23-15-8-6-7-9-16(15)24-19;1-26-18-7-6-12(14-11-22-9-8-15(14)21)10-13(18)19(25-26)20-23-16-4-2-3-5-17(16)24-20;20-14-7-8-21-10-13(14)11-5-6-15-12(9-11)18(25-24-15)19-22-16-3-1-2-4-17(16)23-19;6-4-1-2-8-3-5(4)7/h6-12H,1-5H3,(H,23,24);2-11H,1H3,(H,23,24);1-10H,(H,22,23)(H,24,25);1-3H
InChIKey	SUAMQZWJRALYNA-UHFFFAOYSA-N
XLogP	15.41
TPSA	207.49 Å²
H-Bond Donors	4
H-Bond Acceptors	13
Rotatable Bonds	6
Heavy Atoms	87
Complexity	—

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1319.31
LogP ≤ 5	15.41
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	13

Computed Properties (RDKit)

Structural Alerts	{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

Related Compounds

Frequently Asked Questions

What is the IUPAC name of 3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1H-indazole;3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1-methylindazole;3-(1H-benzimidazol-2-yl)-1-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-chloro-3-iodopyridine?

The IUPAC name of 3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1H-indazole;3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1-methylindazole;3-(1H-benzimidazol-2-yl)-1-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-chloro-3-iodopyridine (CID 160937220) is 3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1H-indazole;3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1-methylindazole;3-(1H-benzimidazol-2-yl)-1-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-chloro-3-iodopyridine.

What is the SMILES notation for 3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1H-indazole;3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1-methylindazole;3-(1H-benzimidazol-2-yl)-1-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-chloro-3-iodopyridine?

The canonical SMILES for 3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1H-indazole;3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1-methylindazole;3-(1H-benzimidazol-2-yl)-1-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-chloro-3-iodopyridine is Clc1ccncc1-c1ccc2[nH]nc(-c3nc4ccccc4[nH]3)c2c1.Clc1ccncc1I.Cn1nc(-c2nc3ccccc3[nH]2)c2cc(-c3cnccc3Cl)ccc21.Cn1nc(-c2nc3ccccc3[nH]2)c2cc(B3OC(C)(C)C(C)(C)O3)ccc21.

What is the InChIKey of 3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1H-indazole;3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1-methylindazole;3-(1H-benzimidazol-2-yl)-1-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-chloro-3-iodopyridine?

The InChIKey is SUAMQZWJRALYNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23BN4O2.C20H14ClN5.C19H12ClN5.C5H3ClIN/c1-20(2)21(3,4)28-22(27-20)13-10-11-17-14(12-13)18(25-26(17)5)19-23-15-8-6-7-9-16(15)24-19;1-26-18-7-6-12(14-11-22-9-8-15(14)21)10-13(18)19(25-26)20-23-16-4-2-3-5-17(16)24-20;20-14-7-8-21-10-13(14)11-5-6-15-12(9-11)18(25-24-15)19-22-16-3-1-2-4-17(16)23-19;6-4-1-2-8-3-5(4)7/h6-12H,1-5H3,(H,23,24);2-11H,1H3,(H,23,24);1-10H,(H,22,23)(H,24,25);1-3H.

What are the key properties of 3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1H-indazole;3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1-methylindazole;3-(1H-benzimidazol-2-yl)-1-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-chloro-3-iodopyridine?

Where does this data come from?

All data for 3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1H-indazole;3-(1H-benzimidazol-2-yl)-5-(4-chloro-3-pyridinyl)-1-methylindazole;3-(1H-benzimidazol-2-yl)-1-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole;4-chloro-3-iodopyridine is sourced from PubChem (CID 160937220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).