bis(N-[4-(2-acetyl-5-methyl-1,3-thiazol-4-yl)phenyl]-2,6-difluorobenzamide);N-[4-(5-acetyl-2-methylthiophen-3-yl)phenyl]-2-fluoro-6-methylbenzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[4-(2-methyl-5-pyridin-3-ylthiophen-3-yl)phenyl]benzamide;2,6-difluoro-N-[4-[2-methyl-5-(1,3-thiazol-2-yl)thiophen-3-yl]phenyl]benzamide

C142H101F13N16O12S8 — CID 161375222

About bis(N-[4-(2-acetyl-5-methyl-1,3-thiazol-4-yl)phenyl]-2,6-difluorobenzamide);N-[4-(5-acetyl-2-methylthiophen-3-yl)phenyl]-2-fluoro-6-methylbenzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[4-(2-methyl-5-pyridin-3-ylthiophen-3-yl)phenyl]benzamide;2,6-difluoro-N-[4-[2-methyl-5-(1,3-thiazol-2-yl)thiophen-3-yl]phenyl]benzamide

bis(N-[4-(2-acetyl-5-methyl-1,3-thiazol-4-yl)phenyl]-2,6-difluorobenzamide);N-[4-(5-acetyl-2-methylthiophen-3-yl)phenyl]-2-fluoro-6-methylbenzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[4-(2-methyl-5-pyridin-3-ylthiophen-3-yl)phenyl]benzamide;2,6-difluoro-N-[4-[2-methyl-5-(1,3-thiazol-2-yl)thiophen-3-yl]phenyl]benzamide (PubChem CID 161375222) has the molecular formula C142H101F13N16O12S8 and a molecular weight of 2726.98 g/mol. Its IUPAC name is bis(N-[4-(2-acetyl-5-methyl-1,3-thiazol-4-yl)phenyl]-2,6-difluorobenzamide);N-[4-(5-acetyl-2-methylthiophen-3-yl)phenyl]-2-fluoro-6-methylbenzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[4-(2-methyl-5-pyridin-3-ylthiophen-3-yl)phenyl]benzamide;2,6-difluoro-N-[4-[2-methyl-5-(1,3-thiazol-2-yl)thiophen-3-yl]phenyl]benzamide.

Molecular Properties

• Compound Name: bis(N-[4-(2-acetyl-5-methyl-1,3-thiazol-4-yl)phenyl]-2,6-difluorobenzamide);N-[4-(5-acetyl-2-methylthiophen-3-yl)phenyl]-2-fluoro-6-methylbenzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[4-(2-methyl-5-pyridin-3-ylthiophen-3-yl)phenyl]benzamide;2,6-difluoro-N-[4-[2-methyl-5-(1,3-thiazol-2-yl)thiophen-3-yl]phenyl]benzamide
• PubChem CID: 161375222
• Molecular Formula: C142H101F13N16O12S8
• Molecular Weight: 2726.98 g/mol
• Exact Mass: 2724.53
• IUPAC Name: bis(N-[4-(2-acetyl-5-methyl-1,3-thiazol-4-yl)phenyl]-2,6-difluorobenzamide);N-[4-(5-acetyl-2-methylthiophen-3-yl)phenyl]-2-fluoro-6-methylbenzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[4-(2-methyl-5-pyridin-3-ylthiophen-3-yl)phenyl]benzamide;2,6-difluoro-N-[4-[2-methyl-5-(1,3-thiazol-2-yl)thiophen-3-yl]phenyl]benzamide
• SMILES: CC(=O)c1cc(-c2ccc(NC(=O)c3c(C)cccc3F)cc2)c(C)s1.CC(=O)c1nc(-c2ccc(NC(=O)c3c(F)cccc3F)cc2)c(C)s1.CC(=O)c1nc(-c2ccc(NC(=O)c3c(F)cccc3F)cc2)c(C)s1.Cc1sc(-c2cccnc2)cc1-c1ccc(NC(=O)c2c(F)cccc2F)cc1.Cc1sc(-c2cnco2)cc1-c1ccc(NC(=O)c2c(F)cccc2F)nc1.Cc1sc(-c2cnco2)cc1-c1cnc(NC(=O)c2c(F)cccc2F)cn1.Cc1sc(-c2nccs2)cc1-c1ccc(NC(=O)c2c(F)cccc2F)cc1
• InChI: InChI=1S/C23H16F2N2OS.C21H14F2N2OS2.C21H18FNO2S.C20H13F2N3O2S.C19H12F2N4O2S.2C19H14F2N2O2S/c1-14-18(12-21(29-14)16-4-3-11-26-13-16)15-7-9-17(10-8-15)27-23(28)22-19(24)5-2-6-20(22)25;1-12-15(11-18(28-12)21-24-9-10-27-21)13-5-7-14(8-6-13)25-20(26)19-16(22)3-2-4-17(19)23;1-12-5-4-6-18(22)20(12)21(25)23-16-9-7-15(8-10-16)17-11-19(13(2)24)26-14(17)3;1-11-13(7-17(28-11)16-9-23-10-27-16)12-5-6-18(24-8-12)25-20(26)19-14(21)3-2-4-15(19)22;1-10-11(5-16(28-10)15-7-22-9-27-15)14-6-24-17(8-23-14)25-19(26)18-12(20)3-2-4-13(18)21;2*1-10(24)19-23-17(11(2)26-19)12-6-8-13(9-7-12)22-18(25)16-14(20)4-3-5-15(16)21/h2-13H,1H3,(H,27,28);2-11H,1H3,(H,25,26);4-11H,1-3H3,(H,23,25);2-10H,1H3,(H,24,25,26);2-9H,1H3,(H,24,25,26);2*3-9H,1-2H3,(H,22,25)
• InChIKey: VQZJBQZFWRSCGI-UHFFFAOYSA-N
• XLogP: 38.03
• TPSA: 397.20 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 29
• Rotatable Bonds: 28
• Heavy Atoms: 191
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2726.98
LogP ≤ 5	38.03
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	29

Frequently Asked Questions

What is the IUPAC name of bis(N-[4-(2-acetyl-5-methyl-1,3-thiazol-4-yl)phenyl]-2,6-difluorobenzamide);N-[4-(5-acetyl-2-methylthiophen-3-yl)phenyl]-2-fluoro-6-methylbenzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[4-(2-methyl-5-pyridin-3-ylthiophen-3-yl)phenyl]benzamide;2,6-difluoro-N-[4-[2-methyl-5-(1,3-thiazol-2-yl)thiophen-3-yl]phenyl]benzamide?

The IUPAC name of bis(N-[4-(2-acetyl-5-methyl-1,3-thiazol-4-yl)phenyl]-2,6-difluorobenzamide);N-[4-(5-acetyl-2-methylthiophen-3-yl)phenyl]-2-fluoro-6-methylbenzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[4-(2-methyl-5-pyridin-3-ylthiophen-3-yl)phenyl]benzamide;2,6-difluoro-N-[4-[2-methyl-5-(1,3-thiazol-2-yl)thiophen-3-yl]phenyl]benzamide (CID 161375222) is bis(N-[4-(2-acetyl-5-methyl-1,3-thiazol-4-yl)phenyl]-2,6-difluorobenzamide);N-[4-(5-acetyl-2-methylthiophen-3-yl)phenyl]-2-fluoro-6-methylbenzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[4-(2-methyl-5-pyridin-3-ylthiophen-3-yl)phenyl]benzamide;2,6-difluoro-N-[4-[2-methyl-5-(1,3-thiazol-2-yl)thiophen-3-yl]phenyl]benzamide.

What is the SMILES notation for bis(N-[4-(2-acetyl-5-methyl-1,3-thiazol-4-yl)phenyl]-2,6-difluorobenzamide);N-[4-(5-acetyl-2-methylthiophen-3-yl)phenyl]-2-fluoro-6-methylbenzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[4-(2-methyl-5-pyridin-3-ylthiophen-3-yl)phenyl]benzamide;2,6-difluoro-N-[4-[2-methyl-5-(1,3-thiazol-2-yl)thiophen-3-yl]phenyl]benzamide?

The canonical SMILES for bis(N-[4-(2-acetyl-5-methyl-1,3-thiazol-4-yl)phenyl]-2,6-difluorobenzamide);N-[4-(5-acetyl-2-methylthiophen-3-yl)phenyl]-2-fluoro-6-methylbenzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[4-(2-methyl-5-pyridin-3-ylthiophen-3-yl)phenyl]benzamide;2,6-difluoro-N-[4-[2-methyl-5-(1,3-thiazol-2-yl)thiophen-3-yl]phenyl]benzamide is CC(=O)c1cc(-c2ccc(NC(=O)c3c(C)cccc3F)cc2)c(C)s1.CC(=O)c1nc(-c2ccc(NC(=O)c3c(F)cccc3F)cc2)c(C)s1.CC(=O)c1nc(-c2ccc(NC(=O)c3c(F)cccc3F)cc2)c(C)s1.Cc1sc(-c2cccnc2)cc1-c1ccc(NC(=O)c2c(F)cccc2F)cc1.Cc1sc(-c2cnco2)cc1-c1ccc(NC(=O)c2c(F)cccc2F)nc1.Cc1sc(-c2cnco2)cc1-c1cnc(NC(=O)c2c(F)cccc2F)cn1.Cc1sc(-c2nccs2)cc1-c1ccc(NC(=O)c2c(F)cccc2F)cc1.

What is the InChIKey of bis(N-[4-(2-acetyl-5-methyl-1,3-thiazol-4-yl)phenyl]-2,6-difluorobenzamide);N-[4-(5-acetyl-2-methylthiophen-3-yl)phenyl]-2-fluoro-6-methylbenzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[4-(2-methyl-5-pyridin-3-ylthiophen-3-yl)phenyl]benzamide;2,6-difluoro-N-[4-[2-methyl-5-(1,3-thiazol-2-yl)thiophen-3-yl]phenyl]benzamide?

The InChIKey is VQZJBQZFWRSCGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16F2N2OS.C21H14F2N2OS2.C21H18FNO2S.C20H13F2N3O2S.C19H12F2N4O2S.2C19H14F2N2O2S/c1-14-18(12-21(29-14)16-4-3-11-26-13-16)15-7-9-17(10-8-15)27-23(28)22-19(24)5-2-6-20(22)25;1-12-15(11-18(28-12)21-24-9-10-27-21)13-5-7-14(8-6-13)25-20(26)19-16(22)3-2-4-17(19)23;1-12-5-4-6-18(22)20(12)21(25)23-16-9-7-15(8-10-16)17-11-19(13(2)24)26-14(17)3;1-11-13(7-17(28-11)16-9-23-10-27-16)12-5-6-18(24-8-12)25-20(26)19-14(21)3-2-4-15(19)22;1-10-11(5-16(28-10)15-7-22-9-27-15)14-6-24-17(8-23-14)25-19(26)18-12(20)3-2-4-13(18)21;2*1-10(24)19-23-17(11(2)26-19)12-6-8-13(9-7-12)22-18(25)16-14(20)4-3-5-15(16)21/h2-13H,1H3,(H,27,28);2-11H,1H3,(H,25,26);4-11H,1-3H3,(H,23,25);2-10H,1H3,(H,24,25,26);2-9H,1H3,(H,24,25,26);2*3-9H,1-2H3,(H,22,25).

What are the key properties of bis(N-[4-(2-acetyl-5-methyl-1,3-thiazol-4-yl)phenyl]-2,6-difluorobenzamide);N-[4-(5-acetyl-2-methylthiophen-3-yl)phenyl]-2-fluoro-6-methylbenzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[4-(2-methyl-5-pyridin-3-ylthiophen-3-yl)phenyl]benzamide;2,6-difluoro-N-[4-[2-methyl-5-(1,3-thiazol-2-yl)thiophen-3-yl]phenyl]benzamide?

bis(N-[4-(2-acetyl-5-methyl-1,3-thiazol-4-yl)phenyl]-2,6-difluorobenzamide);N-[4-(5-acetyl-2-methylthiophen-3-yl)phenyl]-2-fluoro-6-methylbenzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[4-(2-methyl-5-pyridin-3-ylthiophen-3-yl)phenyl]benzamide;2,6-difluoro-N-[4-[2-methyl-5-(1,3-thiazol-2-yl)thiophen-3-yl]phenyl]benzamide has a molecular weight of 2726.98 g/mol, XLogP of 38.03, 28 rotatable bonds, 7 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for bis(N-[4-(2-acetyl-5-methyl-1,3-thiazol-4-yl)phenyl]-2,6-difluorobenzamide);N-[4-(5-acetyl-2-methylthiophen-3-yl)phenyl]-2-fluoro-6-methylbenzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)thiophen-3-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[4-(2-methyl-5-pyridin-3-ylthiophen-3-yl)phenyl]benzamide;2,6-difluoro-N-[4-[2-methyl-5-(1,3-thiazol-2-yl)thiophen-3-yl]phenyl]benzamide is sourced from PubChem (CID 161375222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).