6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one;6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,7-naphthyridin-2-one;6-[(R)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,8-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(S)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,7-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(R)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,8-naphthyridin-2-one;6-[(S)-(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one

C152H117Cl12F2N31O7 — CID 157075164

About 6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one;6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,7-naphthyridin-2-one;6-[(R)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,8-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(S)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,7-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(R)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,8-naphthyridin-2-one;6-[(S)-(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one

6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one;6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,7-naphthyridin-2-one;6-[(R)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,8-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(S)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,7-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(R)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,8-naphthyridin-2-one;6-[(S)-(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one (PubChem CID 157075164) has the molecular formula C152H117Cl12F2N31O7 and a molecular weight of 2953.25 g/mol. Its IUPAC name is 6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one;6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,7-naphthyridin-2-one;6-[(R)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,8-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(S)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,7-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(R)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,8-naphthyridin-2-one;6-[(S)-(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one.

Molecular Properties

• Compound Name: 6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one;6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,7-naphthyridin-2-one;6-[(R)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,8-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(S)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,7-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(R)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,8-naphthyridin-2-one;6-[(S)-(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one
• PubChem CID: 157075164
• Molecular Formula: C152H117Cl12F2N31O7
• Molecular Weight: 2953.25 g/mol
• Exact Mass: 2945.60
• IUPAC Name: 6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one;6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,7-naphthyridin-2-one;6-[(R)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,8-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(S)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,7-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(R)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,8-naphthyridin-2-one;6-[(S)-(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one
• SMILES: Cn1cncc1[C@@](F)(c1ccc(Cl)cc1)c1cc2c(-c3cccc(Cl)c3)cc(=O)n(C)c2cn1.Cn1cncc1[C@@](F)(c1ccc(Cl)cc1)c1cnc2c(c1)c(-c1cccc(Cl)c1)cc(=O)n2C.Cn1cncc1[C@@](N)(c1ccc(Cl)cc1)c1cc2c(-c3cccc(Cl)n3)cc(=O)n(C)c2cn1.Cn1cncc1[C@@](N)(c1ccc(Cl)cc1)c1ccc2c(n1)c(-c1cccc(Cl)n1)cc(=O)n2C.Cn1cncc1[C@@](N)(c1ccc(Cl)cc1)c1cnc2c(c1)c(-c1cccc(Cl)n1)cc(=O)n2C.Cn1cncc1[C@@](O)(c1ccc(Cl)cc1)c1ccc2c(n1)c(-c1cccc(Cl)n1)cc(=O)n2C
• InChI: InChI=1S/2C26H19Cl2FN4O.3C25H20Cl2N6O.C25H19Cl2N5O2/c1-32-15-30-14-23(32)26(29,17-6-8-19(27)9-7-17)18-11-22-21(16-4-3-5-20(28)10-16)12-24(34)33(2)25(22)31-13-18;1-32-15-30-14-24(32)26(29,17-6-8-18(27)9-7-17)23-11-21-20(16-4-3-5-19(28)10-16)12-25(34)33(2)22(21)13-31-23;1-32-14-29-13-21(32)25(28,15-6-8-17(26)9-7-15)16-10-19-18(20-4-3-5-22(27)31-20)11-23(34)33(2)24(19)30-12-16;1-32-14-29-13-22(32)25(28,15-6-8-16(26)9-7-15)21-10-18-17(19-4-3-5-23(27)31-19)11-24(34)33(2)20(18)12-30-21;1-32-14-29-13-21(32)25(28,15-6-8-16(26)9-7-15)20-11-10-19-24(31-20)17(12-23(34)33(19)2)18-4-3-5-22(27)30-18;1-31-14-28-13-21(31)25(34,15-6-8-16(26)9-7-15)20-11-10-19-24(30-20)17(12-23(33)32(19)2)18-4-3-5-22(27)29-18/h2*3-15H,1-2H3;3*3-14H,28H2,1-2H3;3-14,34H,1-2H3/t2*26-;4*25-/m111111/s1
• InChIKey: ACWSIOXMADVNQB-FDYGOOKESA-N
• XLogP: 28.98
• TPSA: 466.11 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 38
• Rotatable Bonds: 24
• Heavy Atoms: 204
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2953.25
LogP ≤ 5	28.98
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	38

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one;6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,7-naphthyridin-2-one;6-[(R)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,8-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(S)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,7-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(R)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,8-naphthyridin-2-one;6-[(S)-(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one?

The IUPAC name of 6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one;6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,7-naphthyridin-2-one;6-[(R)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,8-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(S)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,7-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(R)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,8-naphthyridin-2-one;6-[(S)-(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one (CID 157075164) is 6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one;6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,7-naphthyridin-2-one;6-[(R)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,8-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(S)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,7-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(R)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,8-naphthyridin-2-one;6-[(S)-(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one.

What is the SMILES notation for 6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one;6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,7-naphthyridin-2-one;6-[(R)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,8-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(S)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,7-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(R)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,8-naphthyridin-2-one;6-[(S)-(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one?

The canonical SMILES for 6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one;6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,7-naphthyridin-2-one;6-[(R)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,8-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(S)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,7-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(R)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,8-naphthyridin-2-one;6-[(S)-(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one is Cn1cncc1[C@@](F)(c1ccc(Cl)cc1)c1cc2c(-c3cccc(Cl)c3)cc(=O)n(C)c2cn1.Cn1cncc1[C@@](F)(c1ccc(Cl)cc1)c1cnc2c(c1)c(-c1cccc(Cl)c1)cc(=O)n2C.Cn1cncc1[C@@](N)(c1ccc(Cl)cc1)c1cc2c(-c3cccc(Cl)n3)cc(=O)n(C)c2cn1.Cn1cncc1[C@@](N)(c1ccc(Cl)cc1)c1ccc2c(n1)c(-c1cccc(Cl)n1)cc(=O)n2C.Cn1cncc1[C@@](N)(c1ccc(Cl)cc1)c1cnc2c(c1)c(-c1cccc(Cl)n1)cc(=O)n2C.Cn1cncc1[C@@](O)(c1ccc(Cl)cc1)c1ccc2c(n1)c(-c1cccc(Cl)n1)cc(=O)n2C.

What is the InChIKey of 6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one;6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,7-naphthyridin-2-one;6-[(R)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,8-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(S)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,7-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(R)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,8-naphthyridin-2-one;6-[(S)-(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one?

The InChIKey is ACWSIOXMADVNQB-FDYGOOKESA-N. The full InChI is InChI=1S/2C26H19Cl2FN4O.3C25H20Cl2N6O.C25H19Cl2N5O2/c1-32-15-30-14-23(32)26(29,17-6-8-19(27)9-7-17)18-11-22-21(16-4-3-5-20(28)10-16)12-24(34)33(2)25(22)31-13-18;1-32-15-30-14-24(32)26(29,17-6-8-18(27)9-7-17)23-11-21-20(16-4-3-5-19(28)10-16)12-25(34)33(2)22(21)13-31-23;1-32-14-29-13-21(32)25(28,15-6-8-17(26)9-7-15)16-10-19-18(20-4-3-5-22(27)31-20)11-23(34)33(2)24(19)30-12-16;1-32-14-29-13-22(32)25(28,15-6-8-16(26)9-7-15)21-10-18-17(19-4-3-5-23(27)31-19)11-24(34)33(2)20(18)12-30-21;1-32-14-29-13-21(32)25(28,15-6-8-16(26)9-7-15)20-11-10-19-24(31-20)17(12-23(34)33(19)2)18-4-3-5-22(27)30-18;1-31-14-28-13-21(31)25(34,15-6-8-16(26)9-7-15)20-11-10-19-24(30-20)17(12-23(33)32(19)2)18-4-3-5-22(27)29-18/h2*3-15H,1-2H3;3*3-14H,28H2,1-2H3;3-14,34H,1-2H3/t2*26-;4*25-/m111111/s1.

What are the key properties of 6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one;6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,7-naphthyridin-2-one;6-[(R)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,8-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(S)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,7-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(R)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,8-naphthyridin-2-one;6-[(S)-(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one?

6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one;6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,7-naphthyridin-2-one;6-[(R)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,8-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(S)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,7-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(R)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,8-naphthyridin-2-one;6-[(S)-(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one has a molecular weight of 2953.25 g/mol, XLogP of 28.98, 24 rotatable bonds, 4 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for 6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one;6-[(S)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,7-naphthyridin-2-one;6-[(R)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,8-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(S)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,7-naphthyridin-2-one;4-(3-chlorophenyl)-6-[(R)-(4-chlorophenyl)-fluoro-(3-methylimidazol-4-yl)methyl]-1-methyl-1,8-naphthyridin-2-one;6-[(S)-(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-4-(6-chloro-2-pyridinyl)-1-methyl-1,5-naphthyridin-2-one is sourced from PubChem (CID 157075164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).