dibutyl-[10-(3-imidazol-3-id-2-ylbenzene-2-id-1-yl)-1H-phenoxazin-1-id-2-yl]-pyridin-2-ylgermane;2-(3,7-ditert-butyl-5-pyridin-2-ylbenzo[b][1]benzogermol-5-yl)-10-(3-indazol-2-id-3-ylbenzene-2-id-1-yl)-1H-phenothiazin-1-ide;2-(10,10-dimethyl-5-pyridin-2-ylbenzo[b][1]benzogermin-5-yl)-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenoxazin-1-ide;tetrakis(gold(3+));[5-methyl-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenazin-1-id-2-yl]-phenyl-pyridin-2-ylgermane

C160H131Au4Ge4N17O2S — CID 160562545

IUPACdibutyl-[10-(3-imidazol-3-id-2-ylbenzene-2-id-1-yl)-1H-phenoxazin-1-id-2-yl]-pyridin-2-ylgermane;2-(3,7-ditert-butyl-5-pyridin-2-ylbenzo[b][1]benzogermol-5-yl)-10-(3-indazol-2-id-3-ylbenzene-2-id-1-yl)-1H-phenothiazin-1-ide;2-(10,10-dimethyl-5-pyridin-2-ylbenzo[b][1]benzogermin-5-yl)-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenoxazin-1-ide;tetrakis(gold(3+));[5-methyl-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenazin-1-id-2-yl]-phenyl-pyridin-2-ylgermane
SMILESCC(C)(C)c1ccc2c(c1)[Ge](c1[c-]c3c(cc1)Sc1ccccc1N3c1[c-]c(-c3[n-]nc4ccccc34)ccc1)(c1ccccn1)c1cc(C(C)(C)C)ccc1-2.CCCC[Ge](CCCC)(c1[c-]c2c(cc1)Oc1ccccc1N2c1[c-]c(-c2ncc[n-]2)ccc1)c1ccccn1.Cc1cc(-c2[c-]c(N3c4[c-]c([GeH](c5ccccc5)c5ccccn5)ccc4N(C)c4ccccc43)ccc2)[n-]n1.Cc1cc(-c2[c-]c(N3c4[c-]c([Ge]5(c6ccccn6)c6ccccc6C(C)(C)c6ccccc65)ccc4Oc4ccccc43)ccc2)[n-]n1.[Au+3].[Au+3].[Au+3].[Au+3]
InChIInChI=1S/C50H41GeN4S.C42H31GeN4O.C34H26GeN5.C34H33GeN4O.4Au/c1-49(2,3)33-21-24-37-38-25-22-34(50(4,5)6)30-41(38)51(40(37)29-33,47-20-11-12-27-52-47)35-23-26-46-44(31-35)55(43-18-9-10-19-45(43)56-46)36-15-13-14-32(28-36)48-39-16-7-8-17-42(39)53-54-48;1-28-25-36(46-45-28)29-13-12-14-31(26-29)47-37-19-8-9-20-39(37)48-40-23-22-30(27-38(40)47)43(41-21-10-11-24-44-41)34-17-6-4-15-32(34)42(2,3)33-16-5-7-18-35(33)43;1-24-21-29(38-37-24)25-11-10-14-28(22-25)40-32-16-7-6-15-30(32)39(2)31-19-18-27(23-33(31)40)35(26-12-4-3-5-13-26)34-17-8-9-20-36-34;1-3-5-19-35(20-6-4-2,33-16-9-10-21-36-33)27-17-18-32-30(25-27)39(29-14-7-8-15-31(29)40-32)28-13-11-12-26(24-28)34-37-22-23-38-34;;;;/h7-27,29-30H,1-6H3;4-25H,1-3H3;3-21,35H,1-2H3;7-18,21-23H,3-6,19-20H2,1-2H3;;;;/q4*-3;4*+3
InChIKeyIQUMUTFHAFOQCV-UHFFFAOYSA-N
MW3434.30 g/mol
LogP28.58
Rot. Bonds23

About dibutyl-[10-(3-imidazol-3-id-2-ylbenzene-2-id-1-yl)-1H-phenoxazin-1-id-2-yl]-pyridin-2-ylgermane;2-(3,7-ditert-butyl-5-pyridin-2-ylbenzo[b][1]benzogermol-5-yl)-10-(3-indazol-2-id-3-ylbenzene-2-id-1-yl)-1H-phenothiazin-1-ide;2-(10,10-dimethyl-5-pyridin-2-ylbenzo[b][1]benzogermin-5-yl)-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenoxazin-1-ide;tetrakis(gold(3+));[5-methyl-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenazin-1-id-2-yl]-phenyl-pyridin-2-ylgermane

dibutyl-[10-(3-imidazol-3-id-2-ylbenzene-2-id-1-yl)-1H-phenoxazin-1-id-2-yl]-pyridin-2-ylgermane;2-(3,7-ditert-butyl-5-pyridin-2-ylbenzo[b][1]benzogermol-5-yl)-10-(3-indazol-2-id-3-ylbenzene-2-id-1-yl)-1H-phenothiazin-1-ide;2-(10,10-dimethyl-5-pyridin-2-ylbenzo[b][1]benzogermin-5-yl)-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenoxazin-1-ide;tetrakis(gold(3+));[5-methyl-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenazin-1-id-2-yl]-phenyl-pyridin-2-ylgermane (PubChem CID 160562545) has the molecular formula C160H131Au4Ge4N17O2S and a molecular weight of 3434.30 g/mol. Its IUPAC name is dibutyl-[10-(3-imidazol-3-id-2-ylbenzene-2-id-1-yl)-1H-phenoxazin-1-id-2-yl]-pyridin-2-ylgermane;2-(3,7-ditert-butyl-5-pyridin-2-ylbenzo[b][1]benzogermol-5-yl)-10-(3-indazol-2-id-3-ylbenzene-2-id-1-yl)-1H-phenothiazin-1-ide;2-(10,10-dimethyl-5-pyridin-2-ylbenzo[b][1]benzogermin-5-yl)-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenoxazin-1-ide;tetrakis(gold(3+));[5-methyl-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenazin-1-id-2-yl]-phenyl-pyridin-2-ylgermane.

Molecular Properties

Compound Namedibutyl-[10-(3-imidazol-3-id-2-ylbenzene-2-id-1-yl)-1H-phenoxazin-1-id-2-yl]-pyridin-2-ylgermane;2-(3,7-ditert-butyl-5-pyridin-2-ylbenzo[b][1]benzogermol-5-yl)-10-(3-indazol-2-id-3-ylbenzene-2-id-1-yl)-1H-phenothiazin-1-ide;2-(10,10-dimethyl-5-pyridin-2-ylbenzo[b][1]benzogermin-5-yl)-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenoxazin-1-ide;tetrakis(gold(3+));[5-methyl-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenazin-1-id-2-yl]-phenyl-pyridin-2-ylgermane
PubChem CID160562545
Molecular FormulaC160H131Au4Ge4N17O2S
Molecular Weight3434.30 g/mol
Exact Mass3437.59
IUPAC Namedibutyl-[10-(3-imidazol-3-id-2-ylbenzene-2-id-1-yl)-1H-phenoxazin-1-id-2-yl]-pyridin-2-ylgermane;2-(3,7-ditert-butyl-5-pyridin-2-ylbenzo[b][1]benzogermol-5-yl)-10-(3-indazol-2-id-3-ylbenzene-2-id-1-yl)-1H-phenothiazin-1-ide;2-(10,10-dimethyl-5-pyridin-2-ylbenzo[b][1]benzogermin-5-yl)-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenoxazin-1-ide;tetrakis(gold(3+));[5-methyl-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenazin-1-id-2-yl]-phenyl-pyridin-2-ylgermane
SMILESCC(C)(C)c1ccc2c(c1)[Ge](c1[c-]c3c(cc1)Sc1ccccc1N3c1[c-]c(-c3[n-]nc4ccccc34)ccc1)(c1ccccn1)c1cc(C(C)(C)C)ccc1-2.CCCC[Ge](CCCC)(c1[c-]c2c(cc1)Oc1ccccc1N2c1[c-]c(-c2ncc[n-]2)ccc1)c1ccccn1.Cc1cc(-c2[c-]c(N3c4[c-]c([GeH](c5ccccc5)c5ccccn5)ccc4N(C)c4ccccc43)ccc2)[n-]n1.Cc1cc(-c2[c-]c(N3c4[c-]c([Ge]5(c6ccccn6)c6ccccc6C(C)(C)c6ccccc65)ccc4Oc4ccccc43)ccc2)[n-]n1.[Au+3].[Au+3].[Au+3].[Au+3]
InChIInChI=1S/C50H41GeN4S.C42H31GeN4O.C34H26GeN5.C34H33GeN4O.4Au/c1-49(2,3)33-21-24-37-38-25-22-34(50(4,5)6)30-41(38)51(40(37)29-33,47-20-11-12-27-52-47)35-23-26-46-44(31-35)55(43-18-9-10-19-45(43)56-46)36-15-13-14-32(28-36)48-39-16-7-8-17-42(39)53-54-48;1-28-25-36(46-45-28)29-13-12-14-31(26-29)47-37-19-8-9-20-39(37)48-40-23-22-30(27-38(40)47)43(41-21-10-11-24-44-41)34-17-6-4-15-32(34)42(2,3)33-16-5-7-18-35(33)43;1-24-21-29(38-37-24)25-11-10-14-28(22-25)40-32-16-7-6-15-30(32)39(2)31-19-18-27(23-33(31)40)35(26-12-4-3-5-13-26)34-17-8-9-20-36-34;1-3-5-19-35(20-6-4-2,33-16-9-10-21-36-33)27-17-18-32-30(25-27)39(29-14-7-8-15-31(29)40-32)28-13-11-12-26(24-28)34-37-22-23-38-34;;;;/h7-27,29-30H,1-6H3;4-25H,1-3H3;3-21,35H,1-2H3;7-18,21-23H,3-6,19-20H2,1-2H3;;;;/q4*-3;4*+3
InChIKeyIQUMUTFHAFOQCV-UHFFFAOYSA-N
XLogP28.58
TPSA194.18 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds23
Heavy Atoms188
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003434.30
LogP ≤ 528.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

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

Analyze dibutyl-[10-(3-imidazol-3-id-2-ylbenzene-2-id-1-yl)-1H-phenoxazin-1-id-2-yl]-pyridin-2-ylgermane;2-(3,7-ditert-butyl-5-pyridin-2-ylbenzo[b][1]benzogermol-5-yl)-10-(3-indazol-2-id-3-ylbenzene-2-id-1-yl)-1H-phenothiazin-1-ide;2-(10,10-dimethyl-5-pyridin-2-ylbenzo[b][1]benzogermin-5-yl)-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenoxazin-1-ide;tetrakis(gold(3+));[5-methyl-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenazin-1-id-2-yl]-phenyl-pyridin-2-ylgermane with MolForge

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Frequently Asked Questions

What is the IUPAC name of dibutyl-[10-(3-imidazol-3-id-2-ylbenzene-2-id-1-yl)-1H-phenoxazin-1-id-2-yl]-pyridin-2-ylgermane;2-(3,7-ditert-butyl-5-pyridin-2-ylbenzo[b][1]benzogermol-5-yl)-10-(3-indazol-2-id-3-ylbenzene-2-id-1-yl)-1H-phenothiazin-1-ide;2-(10,10-dimethyl-5-pyridin-2-ylbenzo[b][1]benzogermin-5-yl)-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenoxazin-1-ide;tetrakis(gold(3+));[5-methyl-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenazin-1-id-2-yl]-phenyl-pyridin-2-ylgermane?
The IUPAC name of dibutyl-[10-(3-imidazol-3-id-2-ylbenzene-2-id-1-yl)-1H-phenoxazin-1-id-2-yl]-pyridin-2-ylgermane;2-(3,7-ditert-butyl-5-pyridin-2-ylbenzo[b][1]benzogermol-5-yl)-10-(3-indazol-2-id-3-ylbenzene-2-id-1-yl)-1H-phenothiazin-1-ide;2-(10,10-dimethyl-5-pyridin-2-ylbenzo[b][1]benzogermin-5-yl)-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenoxazin-1-ide;tetrakis(gold(3+));[5-methyl-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenazin-1-id-2-yl]-phenyl-pyridin-2-ylgermane (CID 160562545) is dibutyl-[10-(3-imidazol-3-id-2-ylbenzene-2-id-1-yl)-1H-phenoxazin-1-id-2-yl]-pyridin-2-ylgermane;2-(3,7-ditert-butyl-5-pyridin-2-ylbenzo[b][1]benzogermol-5-yl)-10-(3-indazol-2-id-3-ylbenzene-2-id-1-yl)-1H-phenothiazin-1-ide;2-(10,10-dimethyl-5-pyridin-2-ylbenzo[b][1]benzogermin-5-yl)-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenoxazin-1-ide;tetrakis(gold(3+));[5-methyl-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenazin-1-id-2-yl]-phenyl-pyridin-2-ylgermane.
What is the SMILES notation for dibutyl-[10-(3-imidazol-3-id-2-ylbenzene-2-id-1-yl)-1H-phenoxazin-1-id-2-yl]-pyridin-2-ylgermane;2-(3,7-ditert-butyl-5-pyridin-2-ylbenzo[b][1]benzogermol-5-yl)-10-(3-indazol-2-id-3-ylbenzene-2-id-1-yl)-1H-phenothiazin-1-ide;2-(10,10-dimethyl-5-pyridin-2-ylbenzo[b][1]benzogermin-5-yl)-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenoxazin-1-ide;tetrakis(gold(3+));[5-methyl-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenazin-1-id-2-yl]-phenyl-pyridin-2-ylgermane?
The canonical SMILES for dibutyl-[10-(3-imidazol-3-id-2-ylbenzene-2-id-1-yl)-1H-phenoxazin-1-id-2-yl]-pyridin-2-ylgermane;2-(3,7-ditert-butyl-5-pyridin-2-ylbenzo[b][1]benzogermol-5-yl)-10-(3-indazol-2-id-3-ylbenzene-2-id-1-yl)-1H-phenothiazin-1-ide;2-(10,10-dimethyl-5-pyridin-2-ylbenzo[b][1]benzogermin-5-yl)-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenoxazin-1-ide;tetrakis(gold(3+));[5-methyl-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenazin-1-id-2-yl]-phenyl-pyridin-2-ylgermane is CC(C)(C)c1ccc2c(c1)[Ge](c1[c-]c3c(cc1)Sc1ccccc1N3c1[c-]c(-c3[n-]nc4ccccc34)ccc1)(c1ccccn1)c1cc(C(C)(C)C)ccc1-2.CCCC[Ge](CCCC)(c1[c-]c2c(cc1)Oc1ccccc1N2c1[c-]c(-c2ncc[n-]2)ccc1)c1ccccn1.Cc1cc(-c2[c-]c(N3c4[c-]c([GeH](c5ccccc5)c5ccccn5)ccc4N(C)c4ccccc43)ccc2)[n-]n1.Cc1cc(-c2[c-]c(N3c4[c-]c([Ge]5(c6ccccn6)c6ccccc6C(C)(C)c6ccccc65)ccc4Oc4ccccc43)ccc2)[n-]n1.[Au+3].[Au+3].[Au+3].[Au+3].
What is the InChIKey of dibutyl-[10-(3-imidazol-3-id-2-ylbenzene-2-id-1-yl)-1H-phenoxazin-1-id-2-yl]-pyridin-2-ylgermane;2-(3,7-ditert-butyl-5-pyridin-2-ylbenzo[b][1]benzogermol-5-yl)-10-(3-indazol-2-id-3-ylbenzene-2-id-1-yl)-1H-phenothiazin-1-ide;2-(10,10-dimethyl-5-pyridin-2-ylbenzo[b][1]benzogermin-5-yl)-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenoxazin-1-ide;tetrakis(gold(3+));[5-methyl-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenazin-1-id-2-yl]-phenyl-pyridin-2-ylgermane?
The InChIKey is IQUMUTFHAFOQCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H41GeN4S.C42H31GeN4O.C34H26GeN5.C34H33GeN4O.4Au/c1-49(2,3)33-21-24-37-38-25-22-34(50(4,5)6)30-41(38)51(40(37)29-33,47-20-11-12-27-52-47)35-23-26-46-44(31-35)55(43-18-9-10-19-45(43)56-46)36-15-13-14-32(28-36)48-39-16-7-8-17-42(39)53-54-48;1-28-25-36(46-45-28)29-13-12-14-31(26-29)47-37-19-8-9-20-39(37)48-40-23-22-30(27-38(40)47)43(41-21-10-11-24-44-41)34-17-6-4-15-32(34)42(2,3)33-16-5-7-18-35(33)43;1-24-21-29(38-37-24)25-11-10-14-28(22-25)40-32-16-7-6-15-30(32)39(2)31-19-18-27(23-33(31)40)35(26-12-4-3-5-13-26)34-17-8-9-20-36-34;1-3-5-19-35(20-6-4-2,33-16-9-10-21-36-33)27-17-18-32-30(25-27)39(29-14-7-8-15-31(29)40-32)28-13-11-12-26(24-28)34-37-22-23-38-34;;;;/h7-27,29-30H,1-6H3;4-25H,1-3H3;3-21,35H,1-2H3;7-18,21-23H,3-6,19-20H2,1-2H3;;;;/q4*-3;4*+3.
What are the key properties of dibutyl-[10-(3-imidazol-3-id-2-ylbenzene-2-id-1-yl)-1H-phenoxazin-1-id-2-yl]-pyridin-2-ylgermane;2-(3,7-ditert-butyl-5-pyridin-2-ylbenzo[b][1]benzogermol-5-yl)-10-(3-indazol-2-id-3-ylbenzene-2-id-1-yl)-1H-phenothiazin-1-ide;2-(10,10-dimethyl-5-pyridin-2-ylbenzo[b][1]benzogermin-5-yl)-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenoxazin-1-ide;tetrakis(gold(3+));[5-methyl-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenazin-1-id-2-yl]-phenyl-pyridin-2-ylgermane?
dibutyl-[10-(3-imidazol-3-id-2-ylbenzene-2-id-1-yl)-1H-phenoxazin-1-id-2-yl]-pyridin-2-ylgermane;2-(3,7-ditert-butyl-5-pyridin-2-ylbenzo[b][1]benzogermol-5-yl)-10-(3-indazol-2-id-3-ylbenzene-2-id-1-yl)-1H-phenothiazin-1-ide;2-(10,10-dimethyl-5-pyridin-2-ylbenzo[b][1]benzogermin-5-yl)-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenoxazin-1-ide;tetrakis(gold(3+));[5-methyl-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenazin-1-id-2-yl]-phenyl-pyridin-2-ylgermane has a molecular weight of 3434.30 g/mol, XLogP of 28.58, 23 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for dibutyl-[10-(3-imidazol-3-id-2-ylbenzene-2-id-1-yl)-1H-phenoxazin-1-id-2-yl]-pyridin-2-ylgermane;2-(3,7-ditert-butyl-5-pyridin-2-ylbenzo[b][1]benzogermol-5-yl)-10-(3-indazol-2-id-3-ylbenzene-2-id-1-yl)-1H-phenothiazin-1-ide;2-(10,10-dimethyl-5-pyridin-2-ylbenzo[b][1]benzogermin-5-yl)-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenoxazin-1-ide;tetrakis(gold(3+));[5-methyl-10-[3-(5-methylpyrazol-2-id-3-yl)benzene-2-id-1-yl]-1H-phenazin-1-id-2-yl]-phenyl-pyridin-2-ylgermane is sourced from PubChem (CID 160562545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).