5-[4-chloro-5-[3-chloro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;5-[5-chloro-3-methyl-4-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[4-fluoro-3-methyl-5-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[5-[3-fluoro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;2-(1,3-thiazol-5-ylmethyl)-3H-isoindol-1-one

C84H65Cl3F2N22O9S9 — CID 159850813

About 5-[4-chloro-5-[3-chloro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;5-[5-chloro-3-methyl-4-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[4-fluoro-3-methyl-5-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[5-[3-fluoro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;2-(1,3-thiazol-5-ylmethyl)-3H-isoindol-1-one

5-[4-chloro-5-[3-chloro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;5-[5-chloro-3-methyl-4-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[4-fluoro-3-methyl-5-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[5-[3-fluoro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;2-(1,3-thiazol-5-ylmethyl)-3H-isoindol-1-one (PubChem CID 159850813) has the molecular formula C84H65Cl3F2N22O9S9 and a molecular weight of 1959.55 g/mol. Its IUPAC name is 5-[4-chloro-5-[3-chloro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;5-[5-chloro-3-methyl-4-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[4-fluoro-3-methyl-5-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[5-[3-fluoro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;2-(1,3-thiazol-5-ylmethyl)-3H-isoindol-1-one.

Molecular Properties

• Compound Name: 5-[4-chloro-5-[3-chloro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;5-[5-chloro-3-methyl-4-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[4-fluoro-3-methyl-5-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[5-[3-fluoro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;2-(1,3-thiazol-5-ylmethyl)-3H-isoindol-1-one
• PubChem CID: 159850813
• Molecular Formula: C84H65Cl3F2N22O9S9
• Molecular Weight: 1959.55 g/mol
• Exact Mass: 1956.18
• IUPAC Name: 5-[4-chloro-5-[3-chloro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;5-[5-chloro-3-methyl-4-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[4-fluoro-3-methyl-5-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[5-[3-fluoro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;2-(1,3-thiazol-5-ylmethyl)-3H-isoindol-1-one
• SMILES: Cc1cc(-c2ccc(-c3cncs3)c(F)c2)n(-c2ccc(S(N)(=O)=O)nc2)n1.Cc1nn(-c2ccc(S(N)(=O)=O)nc2)c(-c2ccc(-c3cncs3)c(Cl)c2)c1Cl.Cc1nn(-c2ccc(S(N)(=O)=O)nc2)c(-c2ccc(-c3cncs3)cc2)c1F.Cc1nn(-c2ccc(S(N)(=O)=O)nc2)c(Cl)c1-c1ccc(-c2cncs2)cc1.O=C1c2ccccc2CN1Cc1cncs1
• InChI: InChI=1S/C18H13Cl2N5O2S2.C18H14ClN5O2S2.2C18H14FN5O2S2.C12H10N2OS/c1-10-17(20)18(11-2-4-13(14(19)6-11)15-8-22-9-28-15)25(24-10)12-3-5-16(23-7-12)29(21,26)27;1-11-17(13-4-2-12(3-5-13)15-9-21-10-27-15)18(19)24(23-11)14-6-7-16(22-8-14)28(20,25)26;1-11-6-16(12-2-4-14(15(19)7-12)17-9-21-10-27-17)24(23-11)13-3-5-18(22-8-13)28(20,25)26;1-11-17(19)18(13-4-2-12(3-5-13)15-9-21-10-27-15)24(23-11)14-6-7-16(22-8-14)28(20,25)26;15-12-11-4-2-1-3-9(11)6-14(12)7-10-5-13-8-16-10/h2-9H,1H3,(H2,21,26,27);3*2-10H,1H3,(H2,20,25,26);1-5,8H,6-7H2
• InChIKey: NPXGTUYGWWYXHS-UHFFFAOYSA-N
• XLogP: 16.59
• TPSA: 448.24 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 31
• Rotatable Bonds: 18
• Heavy Atoms: 129
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1959.55
LogP ≤ 5	16.59
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	31

Frequently Asked Questions

What is the IUPAC name of 5-[4-chloro-5-[3-chloro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;5-[5-chloro-3-methyl-4-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[4-fluoro-3-methyl-5-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[5-[3-fluoro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;2-(1,3-thiazol-5-ylmethyl)-3H-isoindol-1-one?

The IUPAC name of 5-[4-chloro-5-[3-chloro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;5-[5-chloro-3-methyl-4-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[4-fluoro-3-methyl-5-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[5-[3-fluoro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;2-(1,3-thiazol-5-ylmethyl)-3H-isoindol-1-one (CID 159850813) is 5-[4-chloro-5-[3-chloro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;5-[5-chloro-3-methyl-4-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[4-fluoro-3-methyl-5-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[5-[3-fluoro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;2-(1,3-thiazol-5-ylmethyl)-3H-isoindol-1-one.

What is the SMILES notation for 5-[4-chloro-5-[3-chloro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;5-[5-chloro-3-methyl-4-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[4-fluoro-3-methyl-5-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[5-[3-fluoro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;2-(1,3-thiazol-5-ylmethyl)-3H-isoindol-1-one?

The canonical SMILES for 5-[4-chloro-5-[3-chloro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;5-[5-chloro-3-methyl-4-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[4-fluoro-3-methyl-5-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[5-[3-fluoro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;2-(1,3-thiazol-5-ylmethyl)-3H-isoindol-1-one is Cc1cc(-c2ccc(-c3cncs3)c(F)c2)n(-c2ccc(S(N)(=O)=O)nc2)n1.Cc1nn(-c2ccc(S(N)(=O)=O)nc2)c(-c2ccc(-c3cncs3)c(Cl)c2)c1Cl.Cc1nn(-c2ccc(S(N)(=O)=O)nc2)c(-c2ccc(-c3cncs3)cc2)c1F.Cc1nn(-c2ccc(S(N)(=O)=O)nc2)c(Cl)c1-c1ccc(-c2cncs2)cc1.O=C1c2ccccc2CN1Cc1cncs1.

What is the InChIKey of 5-[4-chloro-5-[3-chloro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;5-[5-chloro-3-methyl-4-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[4-fluoro-3-methyl-5-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[5-[3-fluoro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;2-(1,3-thiazol-5-ylmethyl)-3H-isoindol-1-one?

The InChIKey is NPXGTUYGWWYXHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13Cl2N5O2S2.C18H14ClN5O2S2.2C18H14FN5O2S2.C12H10N2OS/c1-10-17(20)18(11-2-4-13(14(19)6-11)15-8-22-9-28-15)25(24-10)12-3-5-16(23-7-12)29(21,26)27;1-11-17(13-4-2-12(3-5-13)15-9-21-10-27-15)18(19)24(23-11)14-6-7-16(22-8-14)28(20,25)26;1-11-6-16(12-2-4-14(15(19)7-12)17-9-21-10-27-17)24(23-11)13-3-5-18(22-8-13)28(20,25)26;1-11-17(19)18(13-4-2-12(3-5-13)15-9-21-10-27-15)24(23-11)14-6-7-16(22-8-14)28(20,25)26;15-12-11-4-2-1-3-9(11)6-14(12)7-10-5-13-8-16-10/h2-9H,1H3,(H2,21,26,27);3*2-10H,1H3,(H2,20,25,26);1-5,8H,6-7H2.

What are the key properties of 5-[4-chloro-5-[3-chloro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;5-[5-chloro-3-methyl-4-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[4-fluoro-3-methyl-5-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[5-[3-fluoro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;2-(1,3-thiazol-5-ylmethyl)-3H-isoindol-1-one?

5-[4-chloro-5-[3-chloro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;5-[5-chloro-3-methyl-4-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[4-fluoro-3-methyl-5-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[5-[3-fluoro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;2-(1,3-thiazol-5-ylmethyl)-3H-isoindol-1-one has a molecular weight of 1959.55 g/mol, XLogP of 16.59, 18 rotatable bonds, 4 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[4-chloro-5-[3-chloro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;5-[5-chloro-3-methyl-4-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[4-fluoro-3-methyl-5-[4-(1,3-thiazol-5-yl)phenyl]pyrazol-1-yl]pyridine-2-sulfonamide;5-[5-[3-fluoro-4-(1,3-thiazol-5-yl)phenyl]-3-methylpyrazol-1-yl]pyridine-2-sulfonamide;2-(1,3-thiazol-5-ylmethyl)-3H-isoindol-1-one is sourced from PubChem (CID 159850813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).