2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-5-fluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylbenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3,6-trifluorobenzamide;2-chloro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide

C111H63Cl6F15N18O18 — CID 158313416

About 2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-5-fluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylbenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3,6-trifluorobenzamide;2-chloro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide

2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-5-fluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylbenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3,6-trifluorobenzamide;2-chloro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide (PubChem CID 158313416) has the molecular formula C111H63Cl6F15N18O18 and a molecular weight of 2434.52 g/mol. Its IUPAC name is 2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-5-fluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylbenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3,6-trifluorobenzamide;2-chloro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide.

Molecular Properties

• Compound Name: 2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-5-fluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylbenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3,6-trifluorobenzamide;2-chloro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide
• PubChem CID: 158313416
• Molecular Formula: C111H63Cl6F15N18O18
• Molecular Weight: 2434.52 g/mol
• Exact Mass: 2430.25
• IUPAC Name: 2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-5-fluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylbenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3,6-trifluorobenzamide;2-chloro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide
• SMILES: Cc1cc2c(cc1-c1cnc(NC(=O)c3ccccc3Cl)cn1)OCO2.Cc1cc2c(cc1-c1cnc(NC(=O)c3ccccc3F)cn1)OCO2.Cc1ccccc1C(=O)Nc1cnc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1.O=C(Nc1cnc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1)c1c(F)ccc(F)c1F.O=C(Nc1cnc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1)c1cc(F)ccc1Cl.O=C(Nc1cnc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1)c1cccc(F)c1F
• InChI: InChI=1S/C19H12ClF2N3O3.C19H14ClN3O3.C19H14FN3O3.C18H8Cl2F3N3O3.C18H7ClF5N3O3.C18H8ClF4N3O3/c1-10-4-2-3-5-11(10)18(26)25-17-9-23-14(8-24-17)12-6-15-16(7-13(12)20)28-19(21,22)27-15;2*1-11-6-16-17(26-10-25-16)7-13(11)15-8-22-18(9-21-15)23-19(24)12-4-2-3-5-14(12)20;19-11-2-1-8(21)3-10(11)17(27)26-16-7-24-13(6-25-16)9-4-14-15(5-12(9)20)29-18(22,23)28-14;19-8-4-13-12(29-18(23,24)30-13)3-7(8)11-5-26-14(6-25-11)27-17(28)15-9(20)1-2-10(21)16(15)22;19-10-5-14-13(28-18(22,23)29-14)4-9(10)12-6-25-15(7-24-12)26-17(27)8-2-1-3-11(20)16(8)21/h2-9H,1H3,(H,24,25,26);2*2-9H,10H2,1H3,(H,22,23,24);1-7H,(H,25,26,27);1-6H,(H,26,27,28);1-7H,(H,25,26,27)
• InChIKey: GNYONROHDWDVEJ-UHFFFAOYSA-N
• XLogP: 26.94
• TPSA: 440.04 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 30
• Rotatable Bonds: 18
• Heavy Atoms: 168
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2434.52
LogP ≤ 5	26.94
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-5-fluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylbenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3,6-trifluorobenzamide;2-chloro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide?

The IUPAC name of 2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-5-fluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylbenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3,6-trifluorobenzamide;2-chloro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide (CID 158313416) is 2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-5-fluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylbenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3,6-trifluorobenzamide;2-chloro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide.

What is the SMILES notation for 2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-5-fluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylbenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3,6-trifluorobenzamide;2-chloro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide?

The canonical SMILES for 2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-5-fluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylbenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3,6-trifluorobenzamide;2-chloro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide is Cc1cc2c(cc1-c1cnc(NC(=O)c3ccccc3Cl)cn1)OCO2.Cc1cc2c(cc1-c1cnc(NC(=O)c3ccccc3F)cn1)OCO2.Cc1ccccc1C(=O)Nc1cnc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1.O=C(Nc1cnc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1)c1c(F)ccc(F)c1F.O=C(Nc1cnc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1)c1cc(F)ccc1Cl.O=C(Nc1cnc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1)c1cccc(F)c1F.

What is the InChIKey of 2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-5-fluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylbenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3,6-trifluorobenzamide;2-chloro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide?

The InChIKey is GNYONROHDWDVEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12ClF2N3O3.C19H14ClN3O3.C19H14FN3O3.C18H8Cl2F3N3O3.C18H7ClF5N3O3.C18H8ClF4N3O3/c1-10-4-2-3-5-11(10)18(26)25-17-9-23-14(8-24-17)12-6-15-16(7-13(12)20)28-19(21,22)27-15;2*1-11-6-16-17(26-10-25-16)7-13(11)15-8-22-18(9-21-15)23-19(24)12-4-2-3-5-14(12)20;19-11-2-1-8(21)3-10(11)17(27)26-16-7-24-13(6-25-16)9-4-14-15(5-12(9)20)29-18(22,23)28-14;19-8-4-13-12(29-18(23,24)30-13)3-7(8)11-5-26-14(6-25-11)27-17(28)15-9(20)1-2-10(21)16(15)22;19-10-5-14-13(28-18(22,23)29-14)4-9(10)12-6-25-15(7-24-12)26-17(27)8-2-1-3-11(20)16(8)21/h2-9H,1H3,(H,24,25,26);2*2-9H,10H2,1H3,(H,22,23,24);1-7H,(H,25,26,27);1-6H,(H,26,27,28);1-7H,(H,25,26,27).

What are the key properties of 2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-5-fluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylbenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3,6-trifluorobenzamide;2-chloro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide?

2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-5-fluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylbenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3,6-trifluorobenzamide;2-chloro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide has a molecular weight of 2434.52 g/mol, XLogP of 26.94, 18 rotatable bonds, 6 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-5-fluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-methylbenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,3,6-trifluorobenzamide;2-chloro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;2-fluoro-N-[5-(6-methyl-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide is sourced from PubChem (CID 158313416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).