4-chloro-5-(4-chloropyrazol-1-yl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-2,5-dipyridin-3-yl-1,3-thiazole;4-chloro-5-(6-fluoro-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-5-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-5-pyridin-2-yl-2-pyridin-3-yl-1,3-thiazole

C64H39Cl5F2N16S5 — CID 159946633

About 4-chloro-5-(4-chloropyrazol-1-yl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-2,5-dipyridin-3-yl-1,3-thiazole;4-chloro-5-(6-fluoro-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-5-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-5-pyridin-2-yl-2-pyridin-3-yl-1,3-thiazole

4-chloro-5-(4-chloropyrazol-1-yl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-2,5-dipyridin-3-yl-1,3-thiazole;4-chloro-5-(6-fluoro-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-5-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-5-pyridin-2-yl-2-pyridin-3-yl-1,3-thiazole (PubChem CID 159946633) has the molecular formula C64H39Cl5F2N16S5 and a molecular weight of 1407.72 g/mol. Its IUPAC name is 4-chloro-5-(4-chloropyrazol-1-yl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-2,5-dipyridin-3-yl-1,3-thiazole;4-chloro-5-(6-fluoro-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-5-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-5-pyridin-2-yl-2-pyridin-3-yl-1,3-thiazole.

Molecular Properties

• Compound Name: 4-chloro-5-(4-chloropyrazol-1-yl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-2,5-dipyridin-3-yl-1,3-thiazole;4-chloro-5-(6-fluoro-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-5-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-5-pyridin-2-yl-2-pyridin-3-yl-1,3-thiazole
• PubChem CID: 159946633
• Molecular Formula: C64H39Cl5F2N16S5
• Molecular Weight: 1407.72 g/mol
• Exact Mass: 1404.06
• IUPAC Name: 4-chloro-5-(4-chloropyrazol-1-yl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-2,5-dipyridin-3-yl-1,3-thiazole;4-chloro-5-(6-fluoro-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-5-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-5-pyridin-2-yl-2-pyridin-3-yl-1,3-thiazole
• SMILES: Cc1cccc(-c2sc(-c3cccnc3)nc2Cl)n1.Clc1cnn(-c2sc(-c3cccnc3)nc2Cl)c1.Clc1nc(-c2cccnc2)sc1-c1cccnc1.Fc1cccc(-c2sc(-c3cccnc3)nc2Cl)n1.Fc1nc(-c2cccnc2)sc1-c1ccccn1
• InChI: InChI=1S/C14H10ClN3S.C13H7ClFN3S.C13H8ClN3S.C13H8FN3S.C11H6Cl2N4S/c1-9-4-2-6-11(17-9)12-13(15)18-14(19-12)10-5-3-7-16-8-10;14-12-11(9-4-1-5-10(15)17-9)19-13(18-12)8-3-2-6-16-7-8;14-12-11(9-3-1-5-15-7-9)18-13(17-12)10-4-2-6-16-8-10;14-12-11(10-5-1-2-7-16-10)18-13(17-12)9-4-3-6-15-8-9;12-8-5-15-17(6-8)11-9(13)16-10(18-11)7-2-1-3-14-4-7/h2-8H,1H3;1-7H;2*1-8H;1-6H
• InChIKey: OBONDSDQPKAXAR-UHFFFAOYSA-N
• XLogP: 19.31
• TPSA: 198.28 Ų
• H-Bond Acceptors: 21
• Rotatable Bonds: 10
• Heavy Atoms: 92
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1407.72
LogP ≤ 5	19.31
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-chloro-5-(4-chloropyrazol-1-yl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-2,5-dipyridin-3-yl-1,3-thiazole;4-chloro-5-(6-fluoro-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-5-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-5-pyridin-2-yl-2-pyridin-3-yl-1,3-thiazole?

The IUPAC name of 4-chloro-5-(4-chloropyrazol-1-yl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-2,5-dipyridin-3-yl-1,3-thiazole;4-chloro-5-(6-fluoro-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-5-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-5-pyridin-2-yl-2-pyridin-3-yl-1,3-thiazole (CID 159946633) is 4-chloro-5-(4-chloropyrazol-1-yl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-2,5-dipyridin-3-yl-1,3-thiazole;4-chloro-5-(6-fluoro-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-5-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-5-pyridin-2-yl-2-pyridin-3-yl-1,3-thiazole.

What is the SMILES notation for 4-chloro-5-(4-chloropyrazol-1-yl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-2,5-dipyridin-3-yl-1,3-thiazole;4-chloro-5-(6-fluoro-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-5-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-5-pyridin-2-yl-2-pyridin-3-yl-1,3-thiazole?

The canonical SMILES for 4-chloro-5-(4-chloropyrazol-1-yl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-2,5-dipyridin-3-yl-1,3-thiazole;4-chloro-5-(6-fluoro-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-5-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-5-pyridin-2-yl-2-pyridin-3-yl-1,3-thiazole is Cc1cccc(-c2sc(-c3cccnc3)nc2Cl)n1.Clc1cnn(-c2sc(-c3cccnc3)nc2Cl)c1.Clc1nc(-c2cccnc2)sc1-c1cccnc1.Fc1cccc(-c2sc(-c3cccnc3)nc2Cl)n1.Fc1nc(-c2cccnc2)sc1-c1ccccn1.

What is the InChIKey of 4-chloro-5-(4-chloropyrazol-1-yl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-2,5-dipyridin-3-yl-1,3-thiazole;4-chloro-5-(6-fluoro-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-5-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-5-pyridin-2-yl-2-pyridin-3-yl-1,3-thiazole?

The InChIKey is OBONDSDQPKAXAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClN3S.C13H7ClFN3S.C13H8ClN3S.C13H8FN3S.C11H6Cl2N4S/c1-9-4-2-6-11(17-9)12-13(15)18-14(19-12)10-5-3-7-16-8-10;14-12-11(9-4-1-5-10(15)17-9)19-13(18-12)8-3-2-6-16-7-8;14-12-11(9-3-1-5-15-7-9)18-13(17-12)10-4-2-6-16-8-10;14-12-11(10-5-1-2-7-16-10)18-13(17-12)9-4-3-6-15-8-9;12-8-5-15-17(6-8)11-9(13)16-10(18-11)7-2-1-3-14-4-7/h2-8H,1H3;1-7H;2*1-8H;1-6H.

What are the key properties of 4-chloro-5-(4-chloropyrazol-1-yl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-2,5-dipyridin-3-yl-1,3-thiazole;4-chloro-5-(6-fluoro-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-5-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-5-pyridin-2-yl-2-pyridin-3-yl-1,3-thiazole?

4-chloro-5-(4-chloropyrazol-1-yl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-2,5-dipyridin-3-yl-1,3-thiazole;4-chloro-5-(6-fluoro-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-5-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-5-pyridin-2-yl-2-pyridin-3-yl-1,3-thiazole has a molecular weight of 1407.72 g/mol, XLogP of 19.31, 10 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 4-chloro-5-(4-chloropyrazol-1-yl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-2,5-dipyridin-3-yl-1,3-thiazole;4-chloro-5-(6-fluoro-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-chloro-5-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1,3-thiazole;4-fluoro-5-pyridin-2-yl-2-pyridin-3-yl-1,3-thiazole is sourced from PubChem (CID 159946633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).