3-benzyl-5-bromopyrazin-2-amine;8-benzyl-2-[(4-hydroxyphenyl)methyl]-6-[4-(methoxymethyl)phenyl]imidazo[1,2-a]pyrazin-3-ol;3-benzyl-5-[4-(methoxymethyl)phenyl]pyrazin-2-amine;dichloropalladium;1,1-diethoxy-3-(4-methylphenyl)propan-2-one;2-[4-(methoxymethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;bis(triphenylphosphane)

C122H125BBrCl2N9O10P2Pd — CID 159024951

About 3-benzyl-5-bromopyrazin-2-amine;8-benzyl-2-[(4-hydroxyphenyl)methyl]-6-[4-(methoxymethyl)phenyl]imidazo[1,2-a]pyrazin-3-ol;3-benzyl-5-[4-(methoxymethyl)phenyl]pyrazin-2-amine;dichloropalladium;1,1-diethoxy-3-(4-methylphenyl)propan-2-one;2-[4-(methoxymethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;bis(triphenylphosphane)

3-benzyl-5-bromopyrazin-2-amine;8-benzyl-2-[(4-hydroxyphenyl)methyl]-6-[4-(methoxymethyl)phenyl]imidazo[1,2-a]pyrazin-3-ol;3-benzyl-5-[4-(methoxymethyl)phenyl]pyrazin-2-amine;dichloropalladium;1,1-diethoxy-3-(4-methylphenyl)propan-2-one;2-[4-(methoxymethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;bis(triphenylphosphane) (PubChem CID 159024951) has the molecular formula C122H125BBrCl2N9O10P2Pd and a molecular weight of 2207.38 g/mol. Its IUPAC name is 3-benzyl-5-bromopyrazin-2-amine;8-benzyl-2-[(4-hydroxyphenyl)methyl]-6-[4-(methoxymethyl)phenyl]imidazo[1,2-a]pyrazin-3-ol;3-benzyl-5-[4-(methoxymethyl)phenyl]pyrazin-2-amine;dichloropalladium;1,1-diethoxy-3-(4-methylphenyl)propan-2-one;2-[4-(methoxymethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;bis(triphenylphosphane).

Molecular Properties

• Compound Name: 3-benzyl-5-bromopyrazin-2-amine;8-benzyl-2-[(4-hydroxyphenyl)methyl]-6-[4-(methoxymethyl)phenyl]imidazo[1,2-a]pyrazin-3-ol;3-benzyl-5-[4-(methoxymethyl)phenyl]pyrazin-2-amine;dichloropalladium;1,1-diethoxy-3-(4-methylphenyl)propan-2-one;2-[4-(methoxymethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;bis(triphenylphosphane)
• PubChem CID: 159024951
• Molecular Formula: C122H125BBrCl2N9O10P2Pd
• Molecular Weight: 2207.38 g/mol
• Exact Mass: 2203.67
• IUPAC Name: 3-benzyl-5-bromopyrazin-2-amine;8-benzyl-2-[(4-hydroxyphenyl)methyl]-6-[4-(methoxymethyl)phenyl]imidazo[1,2-a]pyrazin-3-ol;3-benzyl-5-[4-(methoxymethyl)phenyl]pyrazin-2-amine;dichloropalladium;1,1-diethoxy-3-(4-methylphenyl)propan-2-one;2-[4-(methoxymethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;bis(triphenylphosphane)
• SMILES: CCOC(OCC)C(=O)Cc1ccc(C)cc1.COCc1ccc(-c2cn3c(O)c(Cc4ccc(O)cc4)nc3c(Cc3ccccc3)n2)cc1.COCc1ccc(-c2cnc(N)c(Cc3ccccc3)n2)cc1.COCc1ccc(B2OC(C)(C)C(C)(C)O2)cc1.Cl[Pd]Cl.Nc1ncc(Br)nc1Cc1ccccc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
• InChI: InChI=1S/C28H25N3O3.C19H19N3O.2C18H15P.C14H21BO3.C14H20O3.C11H10BrN3.2ClH.Pd/c1-34-18-21-7-11-22(12-8-21)26-17-31-27(24(29-26)15-19-5-3-2-4-6-19)30-25(28(31)33)16-20-9-13-23(32)14-10-20;1-23-13-15-7-9-16(10-8-15)18-12-21-19(20)17(22-18)11-14-5-3-2-4-6-14;2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-13(2)14(3,4)18-15(17-13)12-8-6-11(7-9-12)10-16-5;1-4-16-14(17-5-2)13(15)10-12-8-6-11(3)7-9-12;12-10-7-14-11(13)9(15-10)6-8-4-2-1-3-5-8;;;/h2-14,17,32-33H,15-16,18H2,1H3;2-10,12H,11,13H2,1H3,(H2,20,21);2*1-15H;6-9H,10H2,1-5H3;6-9,14H,4-5,10H2,1-3H3;1-5,7H,6H2,(H2,13,14);2*1H;/q;;;;;;;;;+2/p-2
• InChIKey: VIDWZLISYHPMGI-UHFFFAOYSA-L
• XLogP: 23.91
• TPSA: 255.93 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 19
• Rotatable Bonds: 30
• Heavy Atoms: 148
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2207.38
LogP ≤ 5	23.91
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	19

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-benzyl-5-bromopyrazin-2-amine;8-benzyl-2-[(4-hydroxyphenyl)methyl]-6-[4-(methoxymethyl)phenyl]imidazo[1,2-a]pyrazin-3-ol;3-benzyl-5-[4-(methoxymethyl)phenyl]pyrazin-2-amine;dichloropalladium;1,1-diethoxy-3-(4-methylphenyl)propan-2-one;2-[4-(methoxymethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;bis(triphenylphosphane)?

The IUPAC name of 3-benzyl-5-bromopyrazin-2-amine;8-benzyl-2-[(4-hydroxyphenyl)methyl]-6-[4-(methoxymethyl)phenyl]imidazo[1,2-a]pyrazin-3-ol;3-benzyl-5-[4-(methoxymethyl)phenyl]pyrazin-2-amine;dichloropalladium;1,1-diethoxy-3-(4-methylphenyl)propan-2-one;2-[4-(methoxymethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;bis(triphenylphosphane) (CID 159024951) is 3-benzyl-5-bromopyrazin-2-amine;8-benzyl-2-[(4-hydroxyphenyl)methyl]-6-[4-(methoxymethyl)phenyl]imidazo[1,2-a]pyrazin-3-ol;3-benzyl-5-[4-(methoxymethyl)phenyl]pyrazin-2-amine;dichloropalladium;1,1-diethoxy-3-(4-methylphenyl)propan-2-one;2-[4-(methoxymethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;bis(triphenylphosphane).

What is the SMILES notation for 3-benzyl-5-bromopyrazin-2-amine;8-benzyl-2-[(4-hydroxyphenyl)methyl]-6-[4-(methoxymethyl)phenyl]imidazo[1,2-a]pyrazin-3-ol;3-benzyl-5-[4-(methoxymethyl)phenyl]pyrazin-2-amine;dichloropalladium;1,1-diethoxy-3-(4-methylphenyl)propan-2-one;2-[4-(methoxymethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;bis(triphenylphosphane)?

The canonical SMILES for 3-benzyl-5-bromopyrazin-2-amine;8-benzyl-2-[(4-hydroxyphenyl)methyl]-6-[4-(methoxymethyl)phenyl]imidazo[1,2-a]pyrazin-3-ol;3-benzyl-5-[4-(methoxymethyl)phenyl]pyrazin-2-amine;dichloropalladium;1,1-diethoxy-3-(4-methylphenyl)propan-2-one;2-[4-(methoxymethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;bis(triphenylphosphane) is CCOC(OCC)C(=O)Cc1ccc(C)cc1.COCc1ccc(-c2cn3c(O)c(Cc4ccc(O)cc4)nc3c(Cc3ccccc3)n2)cc1.COCc1ccc(-c2cnc(N)c(Cc3ccccc3)n2)cc1.COCc1ccc(B2OC(C)(C)C(C)(C)O2)cc1.Cl[Pd]Cl.Nc1ncc(Br)nc1Cc1ccccc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.

What is the InChIKey of 3-benzyl-5-bromopyrazin-2-amine;8-benzyl-2-[(4-hydroxyphenyl)methyl]-6-[4-(methoxymethyl)phenyl]imidazo[1,2-a]pyrazin-3-ol;3-benzyl-5-[4-(methoxymethyl)phenyl]pyrazin-2-amine;dichloropalladium;1,1-diethoxy-3-(4-methylphenyl)propan-2-one;2-[4-(methoxymethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;bis(triphenylphosphane)?

The InChIKey is VIDWZLISYHPMGI-UHFFFAOYSA-L. The full InChI is InChI=1S/C28H25N3O3.C19H19N3O.2C18H15P.C14H21BO3.C14H20O3.C11H10BrN3.2ClH.Pd/c1-34-18-21-7-11-22(12-8-21)26-17-31-27(24(29-26)15-19-5-3-2-4-6-19)30-25(28(31)33)16-20-9-13-23(32)14-10-20;1-23-13-15-7-9-16(10-8-15)18-12-21-19(20)17(22-18)11-14-5-3-2-4-6-14;2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-13(2)14(3,4)18-15(17-13)12-8-6-11(7-9-12)10-16-5;1-4-16-14(17-5-2)13(15)10-12-8-6-11(3)7-9-12;12-10-7-14-11(13)9(15-10)6-8-4-2-1-3-5-8;;;/h2-14,17,32-33H,15-16,18H2,1H3;2-10,12H,11,13H2,1H3,(H2,20,21);2*1-15H;6-9H,10H2,1-5H3;6-9,14H,4-5,10H2,1-3H3;1-5,7H,6H2,(H2,13,14);2*1H;/q;;;;;;;;;+2/p-2.

What are the key properties of 3-benzyl-5-bromopyrazin-2-amine;8-benzyl-2-[(4-hydroxyphenyl)methyl]-6-[4-(methoxymethyl)phenyl]imidazo[1,2-a]pyrazin-3-ol;3-benzyl-5-[4-(methoxymethyl)phenyl]pyrazin-2-amine;dichloropalladium;1,1-diethoxy-3-(4-methylphenyl)propan-2-one;2-[4-(methoxymethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;bis(triphenylphosphane)?

3-benzyl-5-bromopyrazin-2-amine;8-benzyl-2-[(4-hydroxyphenyl)methyl]-6-[4-(methoxymethyl)phenyl]imidazo[1,2-a]pyrazin-3-ol;3-benzyl-5-[4-(methoxymethyl)phenyl]pyrazin-2-amine;dichloropalladium;1,1-diethoxy-3-(4-methylphenyl)propan-2-one;2-[4-(methoxymethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;bis(triphenylphosphane) has a molecular weight of 2207.38 g/mol, XLogP of 23.91, 30 rotatable bonds, 4 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for 3-benzyl-5-bromopyrazin-2-amine;8-benzyl-2-[(4-hydroxyphenyl)methyl]-6-[4-(methoxymethyl)phenyl]imidazo[1,2-a]pyrazin-3-ol;3-benzyl-5-[4-(methoxymethyl)phenyl]pyrazin-2-amine;dichloropalladium;1,1-diethoxy-3-(4-methylphenyl)propan-2-one;2-[4-(methoxymethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane;bis(triphenylphosphane) is sourced from PubChem (CID 159024951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).