disodium;4-[[4-(5-chloro-2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;6-chloro-N-[4-(morpholin-4-ylmethyl)phenyl]-3-nitropyridin-2-amine;2,6-dichloro-3-nitropyridine;hydride;hydroperoxymethanone;methane;4-[[4-(2-methyl-5-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;4-(morpholin-4-ylmethyl)aniline;oxido formate;palladium;pyridin-4-ylboronic acid;tetrakis(triphenylphosphane)

C156H162BCl4N18Na2O16P4Pd- — CID 163715168

About disodium;4-[[4-(5-chloro-2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;6-chloro-N-[4-(morpholin-4-ylmethyl)phenyl]-3-nitropyridin-2-amine;2,6-dichloro-3-nitropyridine;hydride;hydroperoxymethanone;methane;4-[[4-(2-methyl-5-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;4-(morpholin-4-ylmethyl)aniline;oxido formate;palladium;pyridin-4-ylboronic acid;tetrakis(triphenylphosphane)

disodium;4-[[4-(5-chloro-2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;6-chloro-N-[4-(morpholin-4-ylmethyl)phenyl]-3-nitropyridin-2-amine;2,6-dichloro-3-nitropyridine;hydride;hydroperoxymethanone;methane;4-[[4-(2-methyl-5-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;4-(morpholin-4-ylmethyl)aniline;oxido formate;palladium;pyridin-4-ylboronic acid;tetrakis(triphenylphosphane) (PubChem CID 163715168) has the molecular formula C156H162BCl4N18Na2O16P4Pd- and a molecular weight of 2974.04 g/mol. Its IUPAC name is disodium;4-[[4-(5-chloro-2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;6-chloro-N-[4-(morpholin-4-ylmethyl)phenyl]-3-nitropyridin-2-amine;2,6-dichloro-3-nitropyridine;hydride;hydroperoxymethanone;methane;4-[[4-(2-methyl-5-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;4-(morpholin-4-ylmethyl)aniline;oxido formate;palladium;pyridin-4-ylboronic acid;tetrakis(triphenylphosphane).

Molecular Properties

• Compound Name: disodium;4-[[4-(5-chloro-2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;6-chloro-N-[4-(morpholin-4-ylmethyl)phenyl]-3-nitropyridin-2-amine;2,6-dichloro-3-nitropyridine;hydride;hydroperoxymethanone;methane;4-[[4-(2-methyl-5-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;4-(morpholin-4-ylmethyl)aniline;oxido formate;palladium;pyridin-4-ylboronic acid;tetrakis(triphenylphosphane)
• PubChem CID: 163715168
• Molecular Formula: C156H162BCl4N18Na2O16P4Pd-
• Molecular Weight: 2974.04 g/mol
• Exact Mass: 2969.90
• IUPAC Name: disodium;4-[[4-(5-chloro-2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;6-chloro-N-[4-(morpholin-4-ylmethyl)phenyl]-3-nitropyridin-2-amine;2,6-dichloro-3-nitropyridine;hydride;hydroperoxymethanone;methane;4-[[4-(2-methyl-5-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;4-(morpholin-4-ylmethyl)aniline;oxido formate;palladium;pyridin-4-ylboronic acid;tetrakis(triphenylphosphane)
• SMILES: C.C.C.C.Cc1nc2ccc(-c3ccncc3)nc2n1-c1ccc(CN2CCOCC2)cc1.Cc1nc2ccc(Cl)nc2n1-c1ccc(CN2CCOCC2)cc1.Nc1ccc(CN2CCOCC2)cc1.O=CO[O-].O=[C-]OO.O=[N+]([O-])c1ccc(Cl)nc1Cl.O=[N+]([O-])c1ccc(Cl)nc1Nc1ccc(CN2CCOCC2)cc1.OB(O)c1ccncc1.[H-].[Na+].[Na+].[Pd].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
• InChI: InChI=1S/C23H23N5O.C18H19ClN4O.4C18H15P.C16H17ClN4O3.C11H16N2O.C5H6BNO2.C5H2Cl2N2O2.CH2O3.CHO3.4CH4.2Na.Pd.H/c1-17-25-22-7-6-21(19-8-10-24-11-9-19)26-23(22)28(17)20-4-2-18(3-5-20)16-27-12-14-29-15-13-27;1-13-20-16-6-7-17(19)21-18(16)23(13)15-4-2-14(3-5-15)12-22-8-10-24-11-9-22;4*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;17-15-6-5-14(21(22)23)16(19-15)18-13-3-1-12(2-4-13)11-20-7-9-24-10-8-20;12-11-3-1-10(2-4-11)9-13-5-7-14-8-6-13;8-6(9)5-1-3-7-4-2-5;6-4-2-1-3(9(10)11)5(7)8-4;2*2-1-4-3;;;;;;;;/h2-11H,12-16H2,1H3;2-7H,8-12H2,1H3;4*1-15H;1-6H,7-11H2,(H,18,19);1-4H,5-9,12H2;1-4,8-9H;1-2H;1,3H;3H;4*1H4;;;;/q;;;;;;;;;;;-1;;;;;2*+1;;-1/p-1
• InChIKey: PRHROMWRAUKXCR-UHFFFAOYSA-M
• XLogP: 20.64
• TPSA: 423.54 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 32
• Rotatable Bonds: 30
• Heavy Atoms: 202
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2974.04
LogP ≤ 5	20.64
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of disodium;4-[[4-(5-chloro-2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;6-chloro-N-[4-(morpholin-4-ylmethyl)phenyl]-3-nitropyridin-2-amine;2,6-dichloro-3-nitropyridine;hydride;hydroperoxymethanone;methane;4-[[4-(2-methyl-5-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;4-(morpholin-4-ylmethyl)aniline;oxido formate;palladium;pyridin-4-ylboronic acid;tetrakis(triphenylphosphane)?

The IUPAC name of disodium;4-[[4-(5-chloro-2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;6-chloro-N-[4-(morpholin-4-ylmethyl)phenyl]-3-nitropyridin-2-amine;2,6-dichloro-3-nitropyridine;hydride;hydroperoxymethanone;methane;4-[[4-(2-methyl-5-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;4-(morpholin-4-ylmethyl)aniline;oxido formate;palladium;pyridin-4-ylboronic acid;tetrakis(triphenylphosphane) (CID 163715168) is disodium;4-[[4-(5-chloro-2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;6-chloro-N-[4-(morpholin-4-ylmethyl)phenyl]-3-nitropyridin-2-amine;2,6-dichloro-3-nitropyridine;hydride;hydroperoxymethanone;methane;4-[[4-(2-methyl-5-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;4-(morpholin-4-ylmethyl)aniline;oxido formate;palladium;pyridin-4-ylboronic acid;tetrakis(triphenylphosphane).

What is the SMILES notation for disodium;4-[[4-(5-chloro-2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;6-chloro-N-[4-(morpholin-4-ylmethyl)phenyl]-3-nitropyridin-2-amine;2,6-dichloro-3-nitropyridine;hydride;hydroperoxymethanone;methane;4-[[4-(2-methyl-5-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;4-(morpholin-4-ylmethyl)aniline;oxido formate;palladium;pyridin-4-ylboronic acid;tetrakis(triphenylphosphane)?

The canonical SMILES for disodium;4-[[4-(5-chloro-2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;6-chloro-N-[4-(morpholin-4-ylmethyl)phenyl]-3-nitropyridin-2-amine;2,6-dichloro-3-nitropyridine;hydride;hydroperoxymethanone;methane;4-[[4-(2-methyl-5-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;4-(morpholin-4-ylmethyl)aniline;oxido formate;palladium;pyridin-4-ylboronic acid;tetrakis(triphenylphosphane) is C.C.C.C.Cc1nc2ccc(-c3ccncc3)nc2n1-c1ccc(CN2CCOCC2)cc1.Cc1nc2ccc(Cl)nc2n1-c1ccc(CN2CCOCC2)cc1.Nc1ccc(CN2CCOCC2)cc1.O=CO[O-].O=[C-]OO.O=[N+]([O-])c1ccc(Cl)nc1Cl.O=[N+]([O-])c1ccc(Cl)nc1Nc1ccc(CN2CCOCC2)cc1.OB(O)c1ccncc1.[H-].[Na+].[Na+].[Pd].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.

What is the InChIKey of disodium;4-[[4-(5-chloro-2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;6-chloro-N-[4-(morpholin-4-ylmethyl)phenyl]-3-nitropyridin-2-amine;2,6-dichloro-3-nitropyridine;hydride;hydroperoxymethanone;methane;4-[[4-(2-methyl-5-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;4-(morpholin-4-ylmethyl)aniline;oxido formate;palladium;pyridin-4-ylboronic acid;tetrakis(triphenylphosphane)?

The InChIKey is PRHROMWRAUKXCR-UHFFFAOYSA-M. The full InChI is InChI=1S/C23H23N5O.C18H19ClN4O.4C18H15P.C16H17ClN4O3.C11H16N2O.C5H6BNO2.C5H2Cl2N2O2.CH2O3.CHO3.4CH4.2Na.Pd.H/c1-17-25-22-7-6-21(19-8-10-24-11-9-19)26-23(22)28(17)20-4-2-18(3-5-20)16-27-12-14-29-15-13-27;1-13-20-16-6-7-17(19)21-18(16)23(13)15-4-2-14(3-5-15)12-22-8-10-24-11-9-22;4*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;17-15-6-5-14(21(22)23)16(19-15)18-13-3-1-12(2-4-13)11-20-7-9-24-10-8-20;12-11-3-1-10(2-4-11)9-13-5-7-14-8-6-13;8-6(9)5-1-3-7-4-2-5;6-4-2-1-3(9(10)11)5(7)8-4;2*2-1-4-3;;;;;;;;/h2-11H,12-16H2,1H3;2-7H,8-12H2,1H3;4*1-15H;1-6H,7-11H2,(H,18,19);1-4H,5-9,12H2;1-4,8-9H;1-2H;1,3H;3H;4*1H4;;;;/q;;;;;;;;;;;-1;;;;;2*+1;;-1/p-1.

What are the key properties of disodium;4-[[4-(5-chloro-2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;6-chloro-N-[4-(morpholin-4-ylmethyl)phenyl]-3-nitropyridin-2-amine;2,6-dichloro-3-nitropyridine;hydride;hydroperoxymethanone;methane;4-[[4-(2-methyl-5-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;4-(morpholin-4-ylmethyl)aniline;oxido formate;palladium;pyridin-4-ylboronic acid;tetrakis(triphenylphosphane)?

disodium;4-[[4-(5-chloro-2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;6-chloro-N-[4-(morpholin-4-ylmethyl)phenyl]-3-nitropyridin-2-amine;2,6-dichloro-3-nitropyridine;hydride;hydroperoxymethanone;methane;4-[[4-(2-methyl-5-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;4-(morpholin-4-ylmethyl)aniline;oxido formate;palladium;pyridin-4-ylboronic acid;tetrakis(triphenylphosphane) has a molecular weight of 2974.04 g/mol, XLogP of 20.64, 30 rotatable bonds, 5 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for disodium;4-[[4-(5-chloro-2-methylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;6-chloro-N-[4-(morpholin-4-ylmethyl)phenyl]-3-nitropyridin-2-amine;2,6-dichloro-3-nitropyridine;hydride;hydroperoxymethanone;methane;4-[[4-(2-methyl-5-pyridin-4-ylimidazo[4,5-b]pyridin-3-yl)phenyl]methyl]morpholine;4-(morpholin-4-ylmethyl)aniline;oxido formate;palladium;pyridin-4-ylboronic acid;tetrakis(triphenylphosphane) is sourced from PubChem (CID 163715168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).