bis(6-(2-chloro-3-fluoro-6-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one);6-(6-chloro-3-fluoro-2-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-pyridin-4-yl-1H-1,8-naphthyridin-4-one;6-(3-fluoro-2,6-dimethyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;7-(4-fluorophenyl)-6-pyridin-4-yl-1H-1,8-naphthyridin-4-one

C137H88Cl3F9N22O7 — CID 160848557

IUPACbis(6-(2-chloro-3-fluoro-6-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one);6-(6-chloro-3-fluoro-2-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-pyridin-4-yl-1H-1,8-naphthyridin-4-one;6-(3-fluoro-2,6-dimethyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;7-(4-fluorophenyl)-6-pyridin-4-yl-1H-1,8-naphthyridin-4-one
SMILESCc1cc(-c2cc3c(=O)cc[nH]c3nc2-c2ccccc2)c(F)c(C)n1.Cc1cc(-c2cc3c(=O)cc[nH]c3nc2-c2ccccc2)c(F)c(Cl)n1.Cc1cc(-c2cc3c(=O)cc[nH]c3nc2-c2ccccc2)c(F)c(Cl)n1.Cc1nc(Cl)cc(-c2cc3c(=O)cc[nH]c3nc2-c2ccccc2)c1F.O=c1cc[nH]c2nc(-c3ccc(F)cc3)c(-c3ccncc3)cc12.O=c1cc[nH]c2nc(-c3ccccc3)c(-c3c(F)cncc3F)cc12.O=c1cc[nH]c2nc(-c3ccncc3)c(-c3c(F)cncc3F)cc12
InChIInChI=1S/C21H16FN3O.3C20H13ClFN3O.C19H11F2N3O.C19H12FN3O.C18H10F2N4O/c1-12-10-15(19(22)13(2)24-12)16-11-17-18(26)8-9-23-21(17)25-20(16)14-6-4-3-5-7-14;1-11-18(22)13(10-17(21)24-11)14-9-15-16(26)7-8-23-20(15)25-19(14)12-5-3-2-4-6-12;2*1-11-9-13(17(22)19(21)24-11)14-10-15-16(26)7-8-23-20(15)25-18(14)12-5-3-2-4-6-12;20-14-9-22-10-15(21)17(14)13-8-12-16(25)6-7-23-19(12)24-18(13)11-4-2-1-3-5-11;20-14-3-1-13(2-4-14)18-15(12-5-8-21-9-6-12)11-16-17(24)7-10-22-19(16)23-18;19-13-8-22-9-14(20)16(13)12-7-11-15(25)3-6-23-18(11)24-17(12)10-1-4-21-5-2-10/h3-11H,1-2H3,(H,23,25,26);3*2-10H,1H3,(H,23,25,26);1-10H,(H,23,24,25);1-11H,(H,22,23,24);1-9H,(H,23,24,25)
InChIKeySIYPBRLXZYVTJF-UHFFFAOYSA-N
MW2431.70 g/mol
LogP29.71
Rot. Bonds14

About bis(6-(2-chloro-3-fluoro-6-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one);6-(6-chloro-3-fluoro-2-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-pyridin-4-yl-1H-1,8-naphthyridin-4-one;6-(3-fluoro-2,6-dimethyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;7-(4-fluorophenyl)-6-pyridin-4-yl-1H-1,8-naphthyridin-4-one

bis(6-(2-chloro-3-fluoro-6-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one);6-(6-chloro-3-fluoro-2-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-pyridin-4-yl-1H-1,8-naphthyridin-4-one;6-(3-fluoro-2,6-dimethyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;7-(4-fluorophenyl)-6-pyridin-4-yl-1H-1,8-naphthyridin-4-one (PubChem CID 160848557) has the molecular formula C137H88Cl3F9N22O7 and a molecular weight of 2431.70 g/mol. Its IUPAC name is bis(6-(2-chloro-3-fluoro-6-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one);6-(6-chloro-3-fluoro-2-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-pyridin-4-yl-1H-1,8-naphthyridin-4-one;6-(3-fluoro-2,6-dimethyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;7-(4-fluorophenyl)-6-pyridin-4-yl-1H-1,8-naphthyridin-4-one.

Molecular Properties

Compound Namebis(6-(2-chloro-3-fluoro-6-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one);6-(6-chloro-3-fluoro-2-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-pyridin-4-yl-1H-1,8-naphthyridin-4-one;6-(3-fluoro-2,6-dimethyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;7-(4-fluorophenyl)-6-pyridin-4-yl-1H-1,8-naphthyridin-4-one
PubChem CID160848557
Molecular FormulaC137H88Cl3F9N22O7
Molecular Weight2431.70 g/mol
Exact Mass2428.61
IUPAC Namebis(6-(2-chloro-3-fluoro-6-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one);6-(6-chloro-3-fluoro-2-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-pyridin-4-yl-1H-1,8-naphthyridin-4-one;6-(3-fluoro-2,6-dimethyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;7-(4-fluorophenyl)-6-pyridin-4-yl-1H-1,8-naphthyridin-4-one
SMILESCc1cc(-c2cc3c(=O)cc[nH]c3nc2-c2ccccc2)c(F)c(C)n1.Cc1cc(-c2cc3c(=O)cc[nH]c3nc2-c2ccccc2)c(F)c(Cl)n1.Cc1cc(-c2cc3c(=O)cc[nH]c3nc2-c2ccccc2)c(F)c(Cl)n1.Cc1nc(Cl)cc(-c2cc3c(=O)cc[nH]c3nc2-c2ccccc2)c1F.O=c1cc[nH]c2nc(-c3ccc(F)cc3)c(-c3ccncc3)cc12.O=c1cc[nH]c2nc(-c3ccccc3)c(-c3c(F)cncc3F)cc12.O=c1cc[nH]c2nc(-c3ccncc3)c(-c3c(F)cncc3F)cc12
InChIInChI=1S/C21H16FN3O.3C20H13ClFN3O.C19H11F2N3O.C19H12FN3O.C18H10F2N4O/c1-12-10-15(19(22)13(2)24-12)16-11-17-18(26)8-9-23-21(17)25-20(16)14-6-4-3-5-7-14;1-11-18(22)13(10-17(21)24-11)14-9-15-16(26)7-8-23-20(15)25-19(14)12-5-3-2-4-6-12;2*1-11-9-13(17(22)19(21)24-11)14-10-15-16(26)7-8-23-20(15)25-18(14)12-5-3-2-4-6-12;20-14-9-22-10-15(21)17(14)13-8-12-16(25)6-7-23-19(12)24-18(13)11-4-2-1-3-5-11;20-14-3-1-13(2-4-14)18-15(12-5-8-21-9-6-12)11-16-17(24)7-10-22-19(16)23-18;19-13-8-22-9-14(20)16(13)12-7-11-15(25)3-6-23-18(11)24-17(12)10-1-4-21-5-2-10/h3-11H,1-2H3,(H,23,25,26);3*2-10H,1H3,(H,23,25,26);1-10H,(H,23,24,25);1-11H,(H,22,23,24);1-9H,(H,23,24,25)
InChIKeySIYPBRLXZYVTJF-UHFFFAOYSA-N
XLogP29.71
TPSA423.37 Ų
H-Bond Donors7
H-Bond Acceptors22
Rotatable Bonds14
Heavy Atoms178
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002431.70
LogP ≤ 529.71
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze bis(6-(2-chloro-3-fluoro-6-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one);6-(6-chloro-3-fluoro-2-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-pyridin-4-yl-1H-1,8-naphthyridin-4-one;6-(3-fluoro-2,6-dimethyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;7-(4-fluorophenyl)-6-pyridin-4-yl-1H-1,8-naphthyridin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of bis(6-(2-chloro-3-fluoro-6-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one);6-(6-chloro-3-fluoro-2-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-pyridin-4-yl-1H-1,8-naphthyridin-4-one;6-(3-fluoro-2,6-dimethyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;7-(4-fluorophenyl)-6-pyridin-4-yl-1H-1,8-naphthyridin-4-one?
The IUPAC name of bis(6-(2-chloro-3-fluoro-6-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one);6-(6-chloro-3-fluoro-2-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-pyridin-4-yl-1H-1,8-naphthyridin-4-one;6-(3-fluoro-2,6-dimethyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;7-(4-fluorophenyl)-6-pyridin-4-yl-1H-1,8-naphthyridin-4-one (CID 160848557) is bis(6-(2-chloro-3-fluoro-6-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one);6-(6-chloro-3-fluoro-2-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-pyridin-4-yl-1H-1,8-naphthyridin-4-one;6-(3-fluoro-2,6-dimethyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;7-(4-fluorophenyl)-6-pyridin-4-yl-1H-1,8-naphthyridin-4-one.
What is the SMILES notation for bis(6-(2-chloro-3-fluoro-6-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one);6-(6-chloro-3-fluoro-2-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-pyridin-4-yl-1H-1,8-naphthyridin-4-one;6-(3-fluoro-2,6-dimethyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;7-(4-fluorophenyl)-6-pyridin-4-yl-1H-1,8-naphthyridin-4-one?
The canonical SMILES for bis(6-(2-chloro-3-fluoro-6-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one);6-(6-chloro-3-fluoro-2-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-pyridin-4-yl-1H-1,8-naphthyridin-4-one;6-(3-fluoro-2,6-dimethyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;7-(4-fluorophenyl)-6-pyridin-4-yl-1H-1,8-naphthyridin-4-one is Cc1cc(-c2cc3c(=O)cc[nH]c3nc2-c2ccccc2)c(F)c(C)n1.Cc1cc(-c2cc3c(=O)cc[nH]c3nc2-c2ccccc2)c(F)c(Cl)n1.Cc1cc(-c2cc3c(=O)cc[nH]c3nc2-c2ccccc2)c(F)c(Cl)n1.Cc1nc(Cl)cc(-c2cc3c(=O)cc[nH]c3nc2-c2ccccc2)c1F.O=c1cc[nH]c2nc(-c3ccc(F)cc3)c(-c3ccncc3)cc12.O=c1cc[nH]c2nc(-c3ccccc3)c(-c3c(F)cncc3F)cc12.O=c1cc[nH]c2nc(-c3ccncc3)c(-c3c(F)cncc3F)cc12.
What is the InChIKey of bis(6-(2-chloro-3-fluoro-6-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one);6-(6-chloro-3-fluoro-2-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-pyridin-4-yl-1H-1,8-naphthyridin-4-one;6-(3-fluoro-2,6-dimethyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;7-(4-fluorophenyl)-6-pyridin-4-yl-1H-1,8-naphthyridin-4-one?
The InChIKey is SIYPBRLXZYVTJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16FN3O.3C20H13ClFN3O.C19H11F2N3O.C19H12FN3O.C18H10F2N4O/c1-12-10-15(19(22)13(2)24-12)16-11-17-18(26)8-9-23-21(17)25-20(16)14-6-4-3-5-7-14;1-11-18(22)13(10-17(21)24-11)14-9-15-16(26)7-8-23-20(15)25-19(14)12-5-3-2-4-6-12;2*1-11-9-13(17(22)19(21)24-11)14-10-15-16(26)7-8-23-20(15)25-18(14)12-5-3-2-4-6-12;20-14-9-22-10-15(21)17(14)13-8-12-16(25)6-7-23-19(12)24-18(13)11-4-2-1-3-5-11;20-14-3-1-13(2-4-14)18-15(12-5-8-21-9-6-12)11-16-17(24)7-10-22-19(16)23-18;19-13-8-22-9-14(20)16(13)12-7-11-15(25)3-6-23-18(11)24-17(12)10-1-4-21-5-2-10/h3-11H,1-2H3,(H,23,25,26);3*2-10H,1H3,(H,23,25,26);1-10H,(H,23,24,25);1-11H,(H,22,23,24);1-9H,(H,23,24,25).
What are the key properties of bis(6-(2-chloro-3-fluoro-6-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one);6-(6-chloro-3-fluoro-2-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-pyridin-4-yl-1H-1,8-naphthyridin-4-one;6-(3-fluoro-2,6-dimethyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;7-(4-fluorophenyl)-6-pyridin-4-yl-1H-1,8-naphthyridin-4-one?
bis(6-(2-chloro-3-fluoro-6-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one);6-(6-chloro-3-fluoro-2-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-pyridin-4-yl-1H-1,8-naphthyridin-4-one;6-(3-fluoro-2,6-dimethyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;7-(4-fluorophenyl)-6-pyridin-4-yl-1H-1,8-naphthyridin-4-one has a molecular weight of 2431.70 g/mol, XLogP of 29.71, 14 rotatable bonds, 7 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for bis(6-(2-chloro-3-fluoro-6-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one);6-(6-chloro-3-fluoro-2-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(3,5-difluoro-4-pyridinyl)-7-pyridin-4-yl-1H-1,8-naphthyridin-4-one;6-(3-fluoro-2,6-dimethyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;7-(4-fluorophenyl)-6-pyridin-4-yl-1H-1,8-naphthyridin-4-one is sourced from PubChem (CID 160848557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).