azanide;4,7-bis(4,4,4-trifluorobutyl)-1,10-phenanthroline;tris(dichloroplatinum);dichloroplatinum(2+);4-methyl-7-(4,4,4-trifluorobutyl)-1,10-phenanthroline;4-(4,4,4-trifluorobutyl)-2-[4-(4,4,4-trifluorobutyl)-2-pyridinyl]pyridine

C55H55Cl8F15N8Pt4 — CID 158545222

IUPACazanide;4,7-bis(4,4,4-trifluorobutyl)-1,10-phenanthroline;tris(dichloroplatinum);dichloroplatinum(2+);4-methyl-7-(4,4,4-trifluorobutyl)-1,10-phenanthroline;4-(4,4,4-trifluorobutyl)-2-[4-(4,4,4-trifluorobutyl)-2-pyridinyl]pyridine
SMILESCc1ccnc2c1ccc1c(CCCC(F)(F)F)ccnc12.Cl[Pt+2]Cl.Cl[Pt]Cl.Cl[Pt]Cl.Cl[Pt]Cl.FC(F)(F)CCCc1ccnc(-c2cc(CCCC(F)(F)F)ccn2)c1.FC(F)(F)CCCc1ccnc2c1ccc1c(CCCC(F)(F)F)ccnc12.[NH2-].[NH2-]
InChIInChI=1S/C20H18F6N2.C18H18F6N2.C17H15F3N2.8ClH.2H2N.4Pt/c21-19(22,23)9-1-3-13-7-11-27-17-15(13)5-6-16-14(8-12-28-18(16)17)4-2-10-20(24,25)26;19-17(20,21)7-1-3-13-5-9-25-15(11-13)16-12-14(6-10-26-16)4-2-8-18(22,23)24;1-11-6-9-21-15-13(11)4-5-14-12(7-10-22-16(14)15)3-2-8-17(18,19)20;;;;;;;;;;;;;;/h5-8,11-12H,1-4,9-10H2;5-6,9-12H,1-4,7-8H2;4-7,9-10H,2-3,8H2,1H3;8*1H;2*1H2;;;;/q;;;;;;;;;;;2*-1;3*+2;+4/p-8
InChIKeyHPAJOGNAPGHIAB-UHFFFAOYSA-F
MW2177.01 g/mol
LogP24.38
Rot. Bonds16

About azanide;4,7-bis(4,4,4-trifluorobutyl)-1,10-phenanthroline;tris(dichloroplatinum);dichloroplatinum(2+);4-methyl-7-(4,4,4-trifluorobutyl)-1,10-phenanthroline;4-(4,4,4-trifluorobutyl)-2-[4-(4,4,4-trifluorobutyl)-2-pyridinyl]pyridine

azanide;4,7-bis(4,4,4-trifluorobutyl)-1,10-phenanthroline;tris(dichloroplatinum);dichloroplatinum(2+);4-methyl-7-(4,4,4-trifluorobutyl)-1,10-phenanthroline;4-(4,4,4-trifluorobutyl)-2-[4-(4,4,4-trifluorobutyl)-2-pyridinyl]pyridine (PubChem CID 158545222) has the molecular formula C55H55Cl8F15N8Pt4 and a molecular weight of 2177.01 g/mol. Its IUPAC name is azanide;4,7-bis(4,4,4-trifluorobutyl)-1,10-phenanthroline;tris(dichloroplatinum);dichloroplatinum(2+);4-methyl-7-(4,4,4-trifluorobutyl)-1,10-phenanthroline;4-(4,4,4-trifluorobutyl)-2-[4-(4,4,4-trifluorobutyl)-2-pyridinyl]pyridine.

Molecular Properties

Compound Nameazanide;4,7-bis(4,4,4-trifluorobutyl)-1,10-phenanthroline;tris(dichloroplatinum);dichloroplatinum(2+);4-methyl-7-(4,4,4-trifluorobutyl)-1,10-phenanthroline;4-(4,4,4-trifluorobutyl)-2-[4-(4,4,4-trifluorobutyl)-2-pyridinyl]pyridine
PubChem CID158545222
Molecular FormulaC55H55Cl8F15N8Pt4
Molecular Weight2177.01 g/mol
Exact Mass2172.04
IUPAC Nameazanide;4,7-bis(4,4,4-trifluorobutyl)-1,10-phenanthroline;tris(dichloroplatinum);dichloroplatinum(2+);4-methyl-7-(4,4,4-trifluorobutyl)-1,10-phenanthroline;4-(4,4,4-trifluorobutyl)-2-[4-(4,4,4-trifluorobutyl)-2-pyridinyl]pyridine
SMILESCc1ccnc2c1ccc1c(CCCC(F)(F)F)ccnc12.Cl[Pt+2]Cl.Cl[Pt]Cl.Cl[Pt]Cl.Cl[Pt]Cl.FC(F)(F)CCCc1ccnc(-c2cc(CCCC(F)(F)F)ccn2)c1.FC(F)(F)CCCc1ccnc2c1ccc1c(CCCC(F)(F)F)ccnc12.[NH2-].[NH2-]
InChIInChI=1S/C20H18F6N2.C18H18F6N2.C17H15F3N2.8ClH.2H2N.4Pt/c21-19(22,23)9-1-3-13-7-11-27-17-15(13)5-6-16-14(8-12-28-18(16)17)4-2-10-20(24,25)26;19-17(20,21)7-1-3-13-5-9-25-15(11-13)16-12-14(6-10-26-16)4-2-8-18(22,23)24;1-11-6-9-21-15-13(11)4-5-14-12(7-10-22-16(14)15)3-2-8-17(18,19)20;;;;;;;;;;;;;;/h5-8,11-12H,1-4,9-10H2;5-6,9-12H,1-4,7-8H2;4-7,9-10H,2-3,8H2,1H3;8*1H;2*1H2;;;;/q;;;;;;;;;;;2*-1;3*+2;+4/p-8
InChIKeyHPAJOGNAPGHIAB-UHFFFAOYSA-F
XLogP24.38
TPSA144.34 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds16
Heavy Atoms90
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002177.01
LogP ≤ 524.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze azanide;4,7-bis(4,4,4-trifluorobutyl)-1,10-phenanthroline;tris(dichloroplatinum);dichloroplatinum(2+);4-methyl-7-(4,4,4-trifluorobutyl)-1,10-phenanthroline;4-(4,4,4-trifluorobutyl)-2-[4-(4,4,4-trifluorobutyl)-2-pyridinyl]pyridine with MolForge

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Related Compounds

Tris(1,10-phenanthroline); dichlororuthenium
CID 6096197
Dichlororuthenium--4,7-diphenyl-1,10-phenanthroline (1/3)
CID 11980975
Delta-[ru(Bpy)2dppz]2+
CID 57336495
Bis(1,10-phenanthroline);quinoxalino[2,3-f][1,10]phenanthroline;ruthenium
CID 57339425
Ru(II)(phen)2(phen-cyclen-2H+)
CID 16683884
Ru(II)(phen)2(phen-cyclam-Ni(II)
CID 16683885
Ru(II)(phen)2(phen-cyclam-Cu(II)
CID 16683886
Ru(II)(phen)2(phen-cyclam-Fe(III))
CID 16683887
Ru(II)(phen)2(phen-cyclam-Co(III)-Cl2)
CID 16683888
Ru(II)(phen)2(phen-cyclam-2H+)
CID 16683894
(Tris(1,10-phenanthroline)cobalt(II)) chloride
CID 167251
2,6-Dipyridin-2-ylpyridine;1,10-phenanthroline;ruthenium(2+)
CID 5289316

Frequently Asked Questions

What is the IUPAC name of azanide;4,7-bis(4,4,4-trifluorobutyl)-1,10-phenanthroline;tris(dichloroplatinum);dichloroplatinum(2+);4-methyl-7-(4,4,4-trifluorobutyl)-1,10-phenanthroline;4-(4,4,4-trifluorobutyl)-2-[4-(4,4,4-trifluorobutyl)-2-pyridinyl]pyridine?
The IUPAC name of azanide;4,7-bis(4,4,4-trifluorobutyl)-1,10-phenanthroline;tris(dichloroplatinum);dichloroplatinum(2+);4-methyl-7-(4,4,4-trifluorobutyl)-1,10-phenanthroline;4-(4,4,4-trifluorobutyl)-2-[4-(4,4,4-trifluorobutyl)-2-pyridinyl]pyridine (CID 158545222) is azanide;4,7-bis(4,4,4-trifluorobutyl)-1,10-phenanthroline;tris(dichloroplatinum);dichloroplatinum(2+);4-methyl-7-(4,4,4-trifluorobutyl)-1,10-phenanthroline;4-(4,4,4-trifluorobutyl)-2-[4-(4,4,4-trifluorobutyl)-2-pyridinyl]pyridine.
What is the SMILES notation for azanide;4,7-bis(4,4,4-trifluorobutyl)-1,10-phenanthroline;tris(dichloroplatinum);dichloroplatinum(2+);4-methyl-7-(4,4,4-trifluorobutyl)-1,10-phenanthroline;4-(4,4,4-trifluorobutyl)-2-[4-(4,4,4-trifluorobutyl)-2-pyridinyl]pyridine?
The canonical SMILES for azanide;4,7-bis(4,4,4-trifluorobutyl)-1,10-phenanthroline;tris(dichloroplatinum);dichloroplatinum(2+);4-methyl-7-(4,4,4-trifluorobutyl)-1,10-phenanthroline;4-(4,4,4-trifluorobutyl)-2-[4-(4,4,4-trifluorobutyl)-2-pyridinyl]pyridine is Cc1ccnc2c1ccc1c(CCCC(F)(F)F)ccnc12.Cl[Pt+2]Cl.Cl[Pt]Cl.Cl[Pt]Cl.Cl[Pt]Cl.FC(F)(F)CCCc1ccnc(-c2cc(CCCC(F)(F)F)ccn2)c1.FC(F)(F)CCCc1ccnc2c1ccc1c(CCCC(F)(F)F)ccnc12.[NH2-].[NH2-].
What is the InChIKey of azanide;4,7-bis(4,4,4-trifluorobutyl)-1,10-phenanthroline;tris(dichloroplatinum);dichloroplatinum(2+);4-methyl-7-(4,4,4-trifluorobutyl)-1,10-phenanthroline;4-(4,4,4-trifluorobutyl)-2-[4-(4,4,4-trifluorobutyl)-2-pyridinyl]pyridine?
The InChIKey is HPAJOGNAPGHIAB-UHFFFAOYSA-F. The full InChI is InChI=1S/C20H18F6N2.C18H18F6N2.C17H15F3N2.8ClH.2H2N.4Pt/c21-19(22,23)9-1-3-13-7-11-27-17-15(13)5-6-16-14(8-12-28-18(16)17)4-2-10-20(24,25)26;19-17(20,21)7-1-3-13-5-9-25-15(11-13)16-12-14(6-10-26-16)4-2-8-18(22,23)24;1-11-6-9-21-15-13(11)4-5-14-12(7-10-22-16(14)15)3-2-8-17(18,19)20;;;;;;;;;;;;;;/h5-8,11-12H,1-4,9-10H2;5-6,9-12H,1-4,7-8H2;4-7,9-10H,2-3,8H2,1H3;8*1H;2*1H2;;;;/q;;;;;;;;;;;2*-1;3*+2;+4/p-8.
What are the key properties of azanide;4,7-bis(4,4,4-trifluorobutyl)-1,10-phenanthroline;tris(dichloroplatinum);dichloroplatinum(2+);4-methyl-7-(4,4,4-trifluorobutyl)-1,10-phenanthroline;4-(4,4,4-trifluorobutyl)-2-[4-(4,4,4-trifluorobutyl)-2-pyridinyl]pyridine?
azanide;4,7-bis(4,4,4-trifluorobutyl)-1,10-phenanthroline;tris(dichloroplatinum);dichloroplatinum(2+);4-methyl-7-(4,4,4-trifluorobutyl)-1,10-phenanthroline;4-(4,4,4-trifluorobutyl)-2-[4-(4,4,4-trifluorobutyl)-2-pyridinyl]pyridine has a molecular weight of 2177.01 g/mol, XLogP of 24.38, 16 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for azanide;4,7-bis(4,4,4-trifluorobutyl)-1,10-phenanthroline;tris(dichloroplatinum);dichloroplatinum(2+);4-methyl-7-(4,4,4-trifluorobutyl)-1,10-phenanthroline;4-(4,4,4-trifluorobutyl)-2-[4-(4,4,4-trifluorobutyl)-2-pyridinyl]pyridine is sourced from PubChem (CID 158545222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).