3-chloro-4-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2,5-difluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]propanamide;2,2,2-trifluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide

C112H80ClF7N24O20S12 — CID 159700041

About 3-chloro-4-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2,5-difluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]propanamide;2,2,2-trifluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide

3-chloro-4-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2,5-difluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]propanamide;2,2,2-trifluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide (PubChem CID 159700041) has the molecular formula C112H80ClF7N24O20S12 and a molecular weight of 2635.26 g/mol. Its IUPAC name is 3-chloro-4-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2,5-difluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]propanamide;2,2,2-trifluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide.

Molecular Properties

• Compound Name: 3-chloro-4-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2,5-difluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]propanamide;2,2,2-trifluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide
• PubChem CID: 159700041
• Molecular Formula: C112H80ClF7N24O20S12
• Molecular Weight: 2635.26 g/mol
• Exact Mass: 2632.22
• IUPAC Name: 3-chloro-4-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2,5-difluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]propanamide;2,2,2-trifluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide
• SMILES: CC(Oc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)c2cccnc12.O=C(COc1ccccc1)Nc1ccc(S(=O)(=O)Nc2nccs2)c2cccnc12.O=C(Nc1ccc(S(=O)(=O)Nc2nccs2)c2cccnc12)C(F)(F)F.O=C(Nc1ccc(S(=O)(=O)Nc2nccs2)c2cccnc12)c1cc(F)ccc1F.O=C(Nc1ccc(S(=O)(=O)Nc2nccs2)c2cccnc12)c1ccc(F)c(Cl)c1.O=C(Nc1ccc(S(=O)(=O)Nc2nccs2)c2cccnc12)c1ccccc1F
• InChI: InChI=1S/C21H18N4O4S2.C20H16N4O4S2.C19H12ClFN4O3S2.C19H12F2N4O3S2.C19H13FN4O3S2.C14H9F3N4O3S2/c1-14(29-15-6-3-2-4-7-15)20(26)24-17-9-10-18(16-8-5-11-22-19(16)17)31(27,28)25-21-23-12-13-30-21;25-18(13-28-14-5-2-1-3-6-14)23-16-8-9-17(15-7-4-10-21-19(15)16)30(26,27)24-20-22-11-12-29-20;20-13-10-11(3-4-14(13)21)18(26)24-15-5-6-16(12-2-1-7-22-17(12)15)30(27,28)25-19-23-8-9-29-19;20-11-3-4-14(21)13(10-11)18(26)24-15-5-6-16(12-2-1-7-22-17(12)15)30(27,28)25-19-23-8-9-29-19;20-14-6-2-1-4-12(14)18(25)23-15-7-8-16(13-5-3-9-21-17(13)15)29(26,27)24-19-22-10-11-28-19;15-14(16,17)12(22)20-9-3-4-10(8-2-1-5-18-11(8)9)26(23,24)21-13-19-6-7-25-13/h2-14H,1H3,(H,23,25)(H,24,26);1-12H,13H2,(H,22,24)(H,23,25);2*1-10H,(H,23,25)(H,24,26);1-11H,(H,22,24)(H,23,25);1-7H,(H,19,21)(H,20,22)
• InChIKey: MXMSVZIQOOCDDY-UHFFFAOYSA-N
• XLogP: 22.84
• TPSA: 624.76 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 38
• Rotatable Bonds: 33
• Heavy Atoms: 176
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2635.26
LogP ≤ 5	22.84
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	38

Frequently Asked Questions

What is the IUPAC name of 3-chloro-4-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2,5-difluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]propanamide;2,2,2-trifluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide?

The IUPAC name of 3-chloro-4-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2,5-difluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]propanamide;2,2,2-trifluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide (CID 159700041) is 3-chloro-4-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2,5-difluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]propanamide;2,2,2-trifluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide.

What is the SMILES notation for 3-chloro-4-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2,5-difluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]propanamide;2,2,2-trifluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide?

The canonical SMILES for 3-chloro-4-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2,5-difluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]propanamide;2,2,2-trifluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide is CC(Oc1ccccc1)C(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)c2cccnc12.O=C(COc1ccccc1)Nc1ccc(S(=O)(=O)Nc2nccs2)c2cccnc12.O=C(Nc1ccc(S(=O)(=O)Nc2nccs2)c2cccnc12)C(F)(F)F.O=C(Nc1ccc(S(=O)(=O)Nc2nccs2)c2cccnc12)c1cc(F)ccc1F.O=C(Nc1ccc(S(=O)(=O)Nc2nccs2)c2cccnc12)c1ccc(F)c(Cl)c1.O=C(Nc1ccc(S(=O)(=O)Nc2nccs2)c2cccnc12)c1ccccc1F.

What is the InChIKey of 3-chloro-4-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2,5-difluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]propanamide;2,2,2-trifluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide?

The InChIKey is MXMSVZIQOOCDDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O4S2.C20H16N4O4S2.C19H12ClFN4O3S2.C19H12F2N4O3S2.C19H13FN4O3S2.C14H9F3N4O3S2/c1-14(29-15-6-3-2-4-7-15)20(26)24-17-9-10-18(16-8-5-11-22-19(16)17)31(27,28)25-21-23-12-13-30-21;25-18(13-28-14-5-2-1-3-6-14)23-16-8-9-17(15-7-4-10-21-19(15)16)30(26,27)24-20-22-11-12-29-20;20-13-10-11(3-4-14(13)21)18(26)24-15-5-6-16(12-2-1-7-22-17(12)15)30(27,28)25-19-23-8-9-29-19;20-11-3-4-14(21)13(10-11)18(26)24-15-5-6-16(12-2-1-7-22-17(12)15)30(27,28)25-19-23-8-9-29-19;20-14-6-2-1-4-12(14)18(25)23-15-7-8-16(13-5-3-9-21-17(13)15)29(26,27)24-19-22-10-11-28-19;15-14(16,17)12(22)20-9-3-4-10(8-2-1-5-18-11(8)9)26(23,24)21-13-19-6-7-25-13/h2-14H,1H3,(H,23,25)(H,24,26);1-12H,13H2,(H,22,24)(H,23,25);2*1-10H,(H,23,25)(H,24,26);1-11H,(H,22,24)(H,23,25);1-7H,(H,19,21)(H,20,22).

What are the key properties of 3-chloro-4-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2,5-difluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]propanamide;2,2,2-trifluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide?

3-chloro-4-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2,5-difluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]propanamide;2,2,2-trifluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide has a molecular weight of 2635.26 g/mol, XLogP of 22.84, 33 rotatable bonds, 12 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for 3-chloro-4-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2,5-difluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-fluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]benzamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide;2-phenoxy-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]propanamide;2,2,2-trifluoro-N-[5-(1,3-thiazol-2-ylsulfamoyl)quinolin-8-yl]acetamide is sourced from PubChem (CID 159700041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).