N-acetyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;N-acetyl-3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluorobenzamide;N-butanoyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-N-(cyclohexanecarbonyl)-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-propanoylbenzamide

C122H84Cl7F14N17O21S7 — CID 159329888

About N-acetyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;N-acetyl-3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluorobenzamide;N-butanoyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-N-(cyclohexanecarbonyl)-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-propanoylbenzamide

N-acetyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;N-acetyl-3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluorobenzamide;N-butanoyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-N-(cyclohexanecarbonyl)-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-propanoylbenzamide (PubChem CID 159329888) has the molecular formula C122H84Cl7F14N17O21S7 and a molecular weight of 2862.72 g/mol. Its IUPAC name is N-acetyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;N-acetyl-3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluorobenzamide;N-butanoyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-N-(cyclohexanecarbonyl)-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-propanoylbenzamide.

Molecular Properties

• Compound Name: N-acetyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;N-acetyl-3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluorobenzamide;N-butanoyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-N-(cyclohexanecarbonyl)-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-propanoylbenzamide
• PubChem CID: 159329888
• Molecular Formula: C122H84Cl7F14N17O21S7
• Molecular Weight: 2862.72 g/mol
• Exact Mass: 2857.17
• IUPAC Name: N-acetyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;N-acetyl-3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluorobenzamide;N-butanoyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-N-(cyclohexanecarbonyl)-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-propanoylbenzamide
• SMILES: CC(=O)NC(=O)c1c(F)ccc(OCc2nc3cc(Cl)ccc3s2)c1F.CC(=O)NC(=O)c1c(F)ccc(OCc2nc3cc(Cl)cnc3s2)c1F.CCC(=O)NC(=O)c1c(F)ccc(OCc2nc3cc(Cl)cnc3s2)c1F.CCCC(=O)NC(=O)c1c(F)ccc(OCc2nc3cc(Cl)ccc3s2)c1F.O=C(NC(=O)C1CCCCC1)c1c(F)ccc(OCc2nc3cc(Cl)ccc3s2)c1F.O=CNC(=O)c1c(F)ccc(OCc2nc3cc(Cl)ccc3s2)c1F.O=CNC(=O)c1c(F)ccc(OCc2nc3cc(Cl)cnc3s2)c1F
• InChI: InChI=1S/C22H19ClF2N2O3S.C19H15ClF2N2O3S.C17H12ClF2N3O3S.C17H11ClF2N2O3S.C16H10ClF2N3O3S.C16H9ClF2N2O3S.C15H8ClF2N3O3S/c23-13-6-9-17-15(10-13)26-18(31-17)11-30-16-8-7-14(24)19(20(16)25)22(29)27-21(28)12-4-2-1-3-5-12;1-2-3-15(25)24-19(26)17-11(21)5-6-13(18(17)22)27-9-16-23-12-8-10(20)4-7-14(12)28-16;1-2-12(24)23-16(25)14-9(19)3-4-11(15(14)20)26-7-13-22-10-5-8(18)6-21-17(10)27-13;1-8(23)21-17(24)15-10(19)3-4-12(16(15)20)25-7-14-22-11-6-9(18)2-5-13(11)26-14;1-7(23)21-15(24)13-9(18)2-3-11(14(13)19)25-6-12-22-10-4-8(17)5-20-16(10)26-12;17-8-1-4-12-10(5-8)21-13(25-12)6-24-11-3-2-9(18)14(15(11)19)16(23)20-7-22;16-7-3-9-15(19-4-7)25-11(21-9)5-24-10-2-1-8(17)12(13(10)18)14(23)20-6-22/h6-10,12H,1-5,11H2,(H,27,28,29);4-8H,2-3,9H2,1H3,(H,24,25,26);3-6H,2,7H2,1H3,(H,23,24,25);2-6H,7H2,1H3,(H,21,23,24);2-5H,6H2,1H3,(H,21,23,24);1-5,7H,6H2,(H,20,22,23);1-4,6H,5H2,(H,20,22,23)
• InChIKey: LEVOMXSHXCEHEQ-UHFFFAOYSA-N
• XLogP: 28.72
• TPSA: 516.70 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 38
• Rotatable Bonds: 34
• Heavy Atoms: 188
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2862.72
LogP ≤ 5	28.72
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	38

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-acetyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;N-acetyl-3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluorobenzamide;N-butanoyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-N-(cyclohexanecarbonyl)-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-propanoylbenzamide?

The IUPAC name of N-acetyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;N-acetyl-3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluorobenzamide;N-butanoyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-N-(cyclohexanecarbonyl)-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-propanoylbenzamide (CID 159329888) is N-acetyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;N-acetyl-3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluorobenzamide;N-butanoyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-N-(cyclohexanecarbonyl)-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-propanoylbenzamide.

What is the SMILES notation for N-acetyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;N-acetyl-3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluorobenzamide;N-butanoyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-N-(cyclohexanecarbonyl)-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-propanoylbenzamide?

The canonical SMILES for N-acetyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;N-acetyl-3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluorobenzamide;N-butanoyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-N-(cyclohexanecarbonyl)-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-propanoylbenzamide is CC(=O)NC(=O)c1c(F)ccc(OCc2nc3cc(Cl)ccc3s2)c1F.CC(=O)NC(=O)c1c(F)ccc(OCc2nc3cc(Cl)cnc3s2)c1F.CCC(=O)NC(=O)c1c(F)ccc(OCc2nc3cc(Cl)cnc3s2)c1F.CCCC(=O)NC(=O)c1c(F)ccc(OCc2nc3cc(Cl)ccc3s2)c1F.O=C(NC(=O)C1CCCCC1)c1c(F)ccc(OCc2nc3cc(Cl)ccc3s2)c1F.O=CNC(=O)c1c(F)ccc(OCc2nc3cc(Cl)ccc3s2)c1F.O=CNC(=O)c1c(F)ccc(OCc2nc3cc(Cl)cnc3s2)c1F.

What is the InChIKey of N-acetyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;N-acetyl-3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluorobenzamide;N-butanoyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-N-(cyclohexanecarbonyl)-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-propanoylbenzamide?

The InChIKey is LEVOMXSHXCEHEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19ClF2N2O3S.C19H15ClF2N2O3S.C17H12ClF2N3O3S.C17H11ClF2N2O3S.C16H10ClF2N3O3S.C16H9ClF2N2O3S.C15H8ClF2N3O3S/c23-13-6-9-17-15(10-13)26-18(31-17)11-30-16-8-7-14(24)19(20(16)25)22(29)27-21(28)12-4-2-1-3-5-12;1-2-3-15(25)24-19(26)17-11(21)5-6-13(18(17)22)27-9-16-23-12-8-10(20)4-7-14(12)28-16;1-2-12(24)23-16(25)14-9(19)3-4-11(15(14)20)26-7-13-22-10-5-8(18)6-21-17(10)27-13;1-8(23)21-17(24)15-10(19)3-4-12(16(15)20)25-7-14-22-11-6-9(18)2-5-13(11)26-14;1-7(23)21-15(24)13-9(18)2-3-11(14(13)19)25-6-12-22-10-4-8(17)5-20-16(10)26-12;17-8-1-4-12-10(5-8)21-13(25-12)6-24-11-3-2-9(18)14(15(11)19)16(23)20-7-22;16-7-3-9-15(19-4-7)25-11(21-9)5-24-10-2-1-8(17)12(13(10)18)14(23)20-6-22/h6-10,12H,1-5,11H2,(H,27,28,29);4-8H,2-3,9H2,1H3,(H,24,25,26);3-6H,2,7H2,1H3,(H,23,24,25);2-6H,7H2,1H3,(H,21,23,24);2-5H,6H2,1H3,(H,21,23,24);1-5,7H,6H2,(H,20,22,23);1-4,6H,5H2,(H,20,22,23).

What are the key properties of N-acetyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;N-acetyl-3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluorobenzamide;N-butanoyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-N-(cyclohexanecarbonyl)-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-propanoylbenzamide?

N-acetyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;N-acetyl-3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluorobenzamide;N-butanoyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-N-(cyclohexanecarbonyl)-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-propanoylbenzamide has a molecular weight of 2862.72 g/mol, XLogP of 28.72, 34 rotatable bonds, 7 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for N-acetyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;N-acetyl-3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluorobenzamide;N-butanoyl-3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-N-(cyclohexanecarbonyl)-2,6-difluorobenzamide;3-[(5-chloro-1,3-benzothiazol-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-formylbenzamide;3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluoro-N-propanoylbenzamide is sourced from PubChem (CID 159329888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).