2-[4-[9-(6-amino-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-[6-(hydroxymethyl)-3-pyridinyl]-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-(6-isocyano-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfanyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfonyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-2-oxo-9-[6-(2-oxopropyl)-3-pyridinyl]-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile

C163H142N38O10S2 — CID 159912046

About 2-[4-[9-(6-amino-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-[6-(hydroxymethyl)-3-pyridinyl]-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-(6-isocyano-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfanyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfonyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-2-oxo-9-[6-(2-oxopropyl)-3-pyridinyl]-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile

2-[4-[9-(6-amino-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-[6-(hydroxymethyl)-3-pyridinyl]-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-(6-isocyano-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfanyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfonyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-2-oxo-9-[6-(2-oxopropyl)-3-pyridinyl]-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile (PubChem CID 159912046) has the molecular formula C163H142N38O10S2 and a molecular weight of 2857.32 g/mol. Its IUPAC name is 2-[4-[9-(6-amino-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-[6-(hydroxymethyl)-3-pyridinyl]-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-(6-isocyano-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfanyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfonyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-2-oxo-9-[6-(2-oxopropyl)-3-pyridinyl]-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile.

Molecular Properties

• Compound Name: 2-[4-[9-(6-amino-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-[6-(hydroxymethyl)-3-pyridinyl]-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-(6-isocyano-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfanyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfonyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-2-oxo-9-[6-(2-oxopropyl)-3-pyridinyl]-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile
• PubChem CID: 159912046
• Molecular Formula: C163H142N38O10S2
• Molecular Weight: 2857.32 g/mol
• Exact Mass: 2855.12
• IUPAC Name: 2-[4-[9-(6-amino-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-[6-(hydroxymethyl)-3-pyridinyl]-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-(6-isocyano-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfanyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfonyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-2-oxo-9-[6-(2-oxopropyl)-3-pyridinyl]-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile
• SMILES: CC(=O)Cc1ccc(-c2ccc3ncc4c(c3n2)N(c2ccc(C(C)(C)C#N)cc2)C(=O)N(C)C4)cn1.CN1Cc2cnc3ccc(-c4ccc(CO)nc4)nc3c2N(c2ccc(C(C)(C)C#N)cc2)C1=O.CN1Cc2cnc3ccc(-c4ccc(N)nc4)nc3c2N(c2ccc(C(C)(C)C#N)cc2)C1=O.CN1Cc2cnc3ccc(-c4ccc(S(C)(=O)=O)nc4)nc3c2N(c2ccc(C(C)(C)C#N)cc2)C1=O.CSc1ccc(-c2ccc3ncc4c(c3n2)N(c2ccc(C(C)(C)C#N)cc2)C(=O)N(C)C4)cn1.[C-]#[N+]c1ccc(-c2ccc3ncc4c(c3n2)N(c2ccc(C(C)(C)C#N)cc2)C(=O)N(C)C4)cn1
• InChI: InChI=1S/C29H26N6O2.C27H21N7O.C27H24N6O3S.C27H24N6O2.C27H24N6OS.C26H23N7O/c1-18(36)13-22-8-5-19(14-31-22)24-11-12-25-26(33-24)27-20(15-32-25)16-34(4)28(37)35(27)23-9-6-21(7-10-23)29(2,3)17-30;1-27(2,16-28)19-6-8-20(9-7-19)34-25-18(15-33(4)26(34)35)14-30-22-11-10-21(32-24(22)25)17-5-12-23(29-3)31-13-17;1-27(2,16-28)19-6-8-20(9-7-19)33-25-18(15-32(3)26(33)34)14-29-22-11-10-21(31-24(22)25)17-5-12-23(30-13-17)37(4,35)36;1-27(2,16-28)19-5-8-21(9-6-19)33-25-18(14-32(3)26(33)35)13-30-23-11-10-22(31-24(23)25)17-4-7-20(15-34)29-12-17;1-27(2,16-28)19-6-8-20(9-7-19)33-25-18(15-32(3)26(33)34)14-29-22-11-10-21(31-24(22)25)17-5-12-23(35-4)30-13-17;1-26(2,15-27)18-5-7-19(8-6-18)33-24-17(14-32(3)25(33)34)13-29-21-10-9-20(31-23(21)24)16-4-11-22(28)30-12-16/h5-12,14-15H,13,16H2,1-4H3;5-14H,15H2,1-2,4H3;5-14H,15H2,1-4H3;4-13,34H,14-15H2,1-3H3;5-14H,15H2,1-4H3;4-13H,14H2,1-3H3,(H2,28,30)
• InChIKey: NXHJMZCYSIPWHF-UHFFFAOYSA-N
• XLogP: 31.06
• TPSA: 617.88 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 36
• Rotatable Bonds: 23
• Heavy Atoms: 213
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2857.32
LogP ≤ 5	31.06
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	36

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[4-[9-(6-amino-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-[6-(hydroxymethyl)-3-pyridinyl]-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-(6-isocyano-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfanyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfonyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-2-oxo-9-[6-(2-oxopropyl)-3-pyridinyl]-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile?

The IUPAC name of 2-[4-[9-(6-amino-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-[6-(hydroxymethyl)-3-pyridinyl]-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-(6-isocyano-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfanyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfonyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-2-oxo-9-[6-(2-oxopropyl)-3-pyridinyl]-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile (CID 159912046) is 2-[4-[9-(6-amino-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-[6-(hydroxymethyl)-3-pyridinyl]-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-(6-isocyano-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfanyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfonyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-2-oxo-9-[6-(2-oxopropyl)-3-pyridinyl]-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile.

What is the SMILES notation for 2-[4-[9-(6-amino-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-[6-(hydroxymethyl)-3-pyridinyl]-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-(6-isocyano-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfanyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfonyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-2-oxo-9-[6-(2-oxopropyl)-3-pyridinyl]-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile?

The canonical SMILES for 2-[4-[9-(6-amino-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-[6-(hydroxymethyl)-3-pyridinyl]-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-(6-isocyano-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfanyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfonyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-2-oxo-9-[6-(2-oxopropyl)-3-pyridinyl]-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile is CC(=O)Cc1ccc(-c2ccc3ncc4c(c3n2)N(c2ccc(C(C)(C)C#N)cc2)C(=O)N(C)C4)cn1.CN1Cc2cnc3ccc(-c4ccc(CO)nc4)nc3c2N(c2ccc(C(C)(C)C#N)cc2)C1=O.CN1Cc2cnc3ccc(-c4ccc(N)nc4)nc3c2N(c2ccc(C(C)(C)C#N)cc2)C1=O.CN1Cc2cnc3ccc(-c4ccc(S(C)(=O)=O)nc4)nc3c2N(c2ccc(C(C)(C)C#N)cc2)C1=O.CSc1ccc(-c2ccc3ncc4c(c3n2)N(c2ccc(C(C)(C)C#N)cc2)C(=O)N(C)C4)cn1.[C-]#[N+]c1ccc(-c2ccc3ncc4c(c3n2)N(c2ccc(C(C)(C)C#N)cc2)C(=O)N(C)C4)cn1.

What is the InChIKey of 2-[4-[9-(6-amino-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-[6-(hydroxymethyl)-3-pyridinyl]-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-(6-isocyano-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfanyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfonyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-2-oxo-9-[6-(2-oxopropyl)-3-pyridinyl]-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile?

The InChIKey is NXHJMZCYSIPWHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H26N6O2.C27H21N7O.C27H24N6O3S.C27H24N6O2.C27H24N6OS.C26H23N7O/c1-18(36)13-22-8-5-19(14-31-22)24-11-12-25-26(33-24)27-20(15-32-25)16-34(4)28(37)35(27)23-9-6-21(7-10-23)29(2,3)17-30;1-27(2,16-28)19-6-8-20(9-7-19)34-25-18(15-33(4)26(34)35)14-30-22-11-10-21(32-24(22)25)17-5-12-23(29-3)31-13-17;1-27(2,16-28)19-6-8-20(9-7-19)33-25-18(15-32(3)26(33)34)14-29-22-11-10-21(31-24(22)25)17-5-12-23(30-13-17)37(4,35)36;1-27(2,16-28)19-5-8-21(9-6-19)33-25-18(14-32(3)26(33)35)13-30-23-11-10-22(31-24(23)25)17-4-7-20(15-34)29-12-17;1-27(2,16-28)19-6-8-20(9-7-19)33-25-18(15-32(3)26(33)34)14-29-22-11-10-21(31-24(22)25)17-5-12-23(35-4)30-13-17;1-26(2,15-27)18-5-7-19(8-6-18)33-24-17(14-32(3)25(33)34)13-29-21-10-9-20(31-23(21)24)16-4-11-22(28)30-12-16/h5-12,14-15H,13,16H2,1-4H3;5-14H,15H2,1-2,4H3;5-14H,15H2,1-4H3;4-13,34H,14-15H2,1-3H3;5-14H,15H2,1-4H3;4-13H,14H2,1-3H3,(H2,28,30).

What are the key properties of 2-[4-[9-(6-amino-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-[6-(hydroxymethyl)-3-pyridinyl]-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-(6-isocyano-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfanyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfonyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-2-oxo-9-[6-(2-oxopropyl)-3-pyridinyl]-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile?

2-[4-[9-(6-amino-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-[6-(hydroxymethyl)-3-pyridinyl]-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-(6-isocyano-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfanyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfonyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-2-oxo-9-[6-(2-oxopropyl)-3-pyridinyl]-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile has a molecular weight of 2857.32 g/mol, XLogP of 31.06, 23 rotatable bonds, 2 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[4-[9-(6-amino-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-[6-(hydroxymethyl)-3-pyridinyl]-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-[4-[9-(6-isocyano-3-pyridinyl)-3-methyl-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]-2-methylpropanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfanyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-9-(6-methylsulfonyl-3-pyridinyl)-2-oxo-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile;2-methyl-2-[4-[3-methyl-2-oxo-9-[6-(2-oxopropyl)-3-pyridinyl]-4H-pyrimido[5,4-c][1,5]naphthyridin-1-yl]phenyl]propanenitrile is sourced from PubChem (CID 159912046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).