bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);hexakis(dichloro-(3-phenylinden-1-ylidene)ruthenium);dichloro-(3-phenyl-7-propan-2-yloxonioinden-1-ylidene)ruthenium;bis(1,3-dimethylimidazolidin-2-ide);bis(9-(2-methylpropyl)-9-phosphoniabicyclo[3.3.1]nonane);tris(tributylphosphanium);tris(tricyclohexylphosphanium);tri(propan-2-yloxy)phosphanium

C283H409Cl14N8O4P9Ru7+6 — CID 158025083

IUPACbis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);hexakis(dichloro-(3-phenylinden-1-ylidene)ruthenium);dichloro-(3-phenyl-7-propan-2-yloxonioinden-1-ylidene)ruthenium;bis(1,3-dimethylimidazolidin-2-ide);bis(9-(2-methylpropyl)-9-phosphoniabicyclo[3.3.1]nonane);tris(tributylphosphanium);tris(tricyclohexylphosphanium);tri(propan-2-yloxy)phosphanium
SMILESC1CCC([PH+](C2CCCCC2)C2CCCCC2)CC1.C1CCC([PH+](C2CCCCC2)C2CCCCC2)CC1.C1CCC([PH+](C2CCCCC2)C2CCCCC2)CC1.CC(C)C[PH+]1C2CCCC1CCC2.CC(C)C[PH+]1C2CCCC1CCC2.CC(C)O[PH+](OC(C)C)OC(C)C.CC(C)[OH+]c1cccc2c1C(=[Ru](Cl)Cl)C=C2c1ccccc1.CCCC[PH+](CCCC)CCCC.CCCC[PH+](CCCC)CCCC.CCCC[PH+](CCCC)CCCC.CN1[CH-]N(C)CC1.CN1[CH-]N(C)CC1.Cc1cc(C)c(N2[CH-]N(c3c(C)cc(C)cc3C)CC2)c(C)c1.Cc1cc(C)c(N2[CH-]N(c3c(C)cc(C)cc3C)CC2)c(C)c1.Cl[Ru](Cl)=C1C=C(c2ccccc2)c2ccccc21.Cl[Ru](Cl)=C1C=C(c2ccccc2)c2ccccc21.Cl[Ru](Cl)=C1C=C(c2ccccc2)c2ccccc21.Cl[Ru](Cl)=C1C=C(c2ccccc2)c2ccccc21.Cl[Ru](Cl)=C1C=C(c2ccccc2)c2ccccc21.Cl[Ru](Cl)=C1C=C(c2ccccc2)c2ccccc21
InChIInChI=1S/2C21H27N2.C18H16O.3C18H33P.6C15H10.2C12H23P.3C12H27P.C9H22O3P.2C5H11N2.14ClH.7Ru/c2*1-14-9-16(3)20(17(4)10-14)22-7-8-23(13-22)21-18(5)11-15(2)12-19(21)6;1-13(2)19-18-10-6-9-16-15(11-12-17(16)18)14-7-4-3-5-8-14;3*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;6*1-2-6-12(7-3-1)15-11-10-13-8-4-5-9-14(13)15;2*1-10(2)9-13-11-5-3-6-12(13)8-4-7-11;3*1-4-7-10-13(11-8-5-2)12-9-6-3;1-7(2)10-13(11-8(3)4)12-9(5)6;2*1-6-3-4-7(2)5-6;;;;;;;;;;;;;;;;;;;;;/h2*9-13H,7-8H2,1-6H3;3-11,13H,1-2H3;3*16-18H,1-15H2;6*1-9,11H;2*10-12H,3-9H2,1-2H3;3*4-12H2,1-3H3;7-9,13H,1-6H3;2*5H,3-4H2,1-2H3;14*1H;;;;;;;/q2*-1;;;;;;;;;;;;;;;;+1;2*-1;;;;;;;;;;;;;;;7*+2/p-5
InChIKeyAULGWYXBFREDLC-UHFFFAOYSA-I
MW5470.04 g/mol
LogP86.17
Rot. Bonds59

About bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);hexakis(dichloro-(3-phenylinden-1-ylidene)ruthenium);dichloro-(3-phenyl-7-propan-2-yloxonioinden-1-ylidene)ruthenium;bis(1,3-dimethylimidazolidin-2-ide);bis(9-(2-methylpropyl)-9-phosphoniabicyclo[3.3.1]nonane);tris(tributylphosphanium);tris(tricyclohexylphosphanium);tri(propan-2-yloxy)phosphanium

bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);hexakis(dichloro-(3-phenylinden-1-ylidene)ruthenium);dichloro-(3-phenyl-7-propan-2-yloxonioinden-1-ylidene)ruthenium;bis(1,3-dimethylimidazolidin-2-ide);bis(9-(2-methylpropyl)-9-phosphoniabicyclo[3.3.1]nonane);tris(tributylphosphanium);tris(tricyclohexylphosphanium);tri(propan-2-yloxy)phosphanium (PubChem CID 158025083) has the molecular formula C283H409Cl14N8O4P9Ru7+6 and a molecular weight of 5470.04 g/mol. Its IUPAC name is bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);hexakis(dichloro-(3-phenylinden-1-ylidene)ruthenium);dichloro-(3-phenyl-7-propan-2-yloxonioinden-1-ylidene)ruthenium;bis(1,3-dimethylimidazolidin-2-ide);bis(9-(2-methylpropyl)-9-phosphoniabicyclo[3.3.1]nonane);tris(tributylphosphanium);tris(tricyclohexylphosphanium);tri(propan-2-yloxy)phosphanium.

Molecular Properties

Compound Namebis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);hexakis(dichloro-(3-phenylinden-1-ylidene)ruthenium);dichloro-(3-phenyl-7-propan-2-yloxonioinden-1-ylidene)ruthenium;bis(1,3-dimethylimidazolidin-2-ide);bis(9-(2-methylpropyl)-9-phosphoniabicyclo[3.3.1]nonane);tris(tributylphosphanium);tris(tricyclohexylphosphanium);tri(propan-2-yloxy)phosphanium
PubChem CID158025083
Molecular FormulaC283H409Cl14N8O4P9Ru7+6
Molecular Weight5470.04 g/mol
Exact Mass5465.86
IUPAC Namebis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);hexakis(dichloro-(3-phenylinden-1-ylidene)ruthenium);dichloro-(3-phenyl-7-propan-2-yloxonioinden-1-ylidene)ruthenium;bis(1,3-dimethylimidazolidin-2-ide);bis(9-(2-methylpropyl)-9-phosphoniabicyclo[3.3.1]nonane);tris(tributylphosphanium);tris(tricyclohexylphosphanium);tri(propan-2-yloxy)phosphanium
SMILESC1CCC([PH+](C2CCCCC2)C2CCCCC2)CC1.C1CCC([PH+](C2CCCCC2)C2CCCCC2)CC1.C1CCC([PH+](C2CCCCC2)C2CCCCC2)CC1.CC(C)C[PH+]1C2CCCC1CCC2.CC(C)C[PH+]1C2CCCC1CCC2.CC(C)O[PH+](OC(C)C)OC(C)C.CC(C)[OH+]c1cccc2c1C(=[Ru](Cl)Cl)C=C2c1ccccc1.CCCC[PH+](CCCC)CCCC.CCCC[PH+](CCCC)CCCC.CCCC[PH+](CCCC)CCCC.CN1[CH-]N(C)CC1.CN1[CH-]N(C)CC1.Cc1cc(C)c(N2[CH-]N(c3c(C)cc(C)cc3C)CC2)c(C)c1.Cc1cc(C)c(N2[CH-]N(c3c(C)cc(C)cc3C)CC2)c(C)c1.Cl[Ru](Cl)=C1C=C(c2ccccc2)c2ccccc21.Cl[Ru](Cl)=C1C=C(c2ccccc2)c2ccccc21.Cl[Ru](Cl)=C1C=C(c2ccccc2)c2ccccc21.Cl[Ru](Cl)=C1C=C(c2ccccc2)c2ccccc21.Cl[Ru](Cl)=C1C=C(c2ccccc2)c2ccccc21.Cl[Ru](Cl)=C1C=C(c2ccccc2)c2ccccc21
InChIInChI=1S/2C21H27N2.C18H16O.3C18H33P.6C15H10.2C12H23P.3C12H27P.C9H22O3P.2C5H11N2.14ClH.7Ru/c2*1-14-9-16(3)20(17(4)10-14)22-7-8-23(13-22)21-18(5)11-15(2)12-19(21)6;1-13(2)19-18-10-6-9-16-15(11-12-17(16)18)14-7-4-3-5-8-14;3*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;6*1-2-6-12(7-3-1)15-11-10-13-8-4-5-9-14(13)15;2*1-10(2)9-13-11-5-3-6-12(13)8-4-7-11;3*1-4-7-10-13(11-8-5-2)12-9-6-3;1-7(2)10-13(11-8(3)4)12-9(5)6;2*1-6-3-4-7(2)5-6;;;;;;;;;;;;;;;;;;;;;/h2*9-13H,7-8H2,1-6H3;3-11,13H,1-2H3;3*16-18H,1-15H2;6*1-9,11H;2*10-12H,3-9H2,1-2H3;3*4-12H2,1-3H3;7-9,13H,1-6H3;2*5H,3-4H2,1-2H3;14*1H;;;;;;;/q2*-1;;;;;;;;;;;;;;;;+1;2*-1;;;;;;;;;;;;;;;7*+2/p-5
InChIKeyAULGWYXBFREDLC-UHFFFAOYSA-I
XLogP86.17
TPSA66.41 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds59
Heavy Atoms325
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005470.04
LogP ≤ 586.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Analyze bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);hexakis(dichloro-(3-phenylinden-1-ylidene)ruthenium);dichloro-(3-phenyl-7-propan-2-yloxonioinden-1-ylidene)ruthenium;bis(1,3-dimethylimidazolidin-2-ide);bis(9-(2-methylpropyl)-9-phosphoniabicyclo[3.3.1]nonane);tris(tributylphosphanium);tris(tricyclohexylphosphanium);tri(propan-2-yloxy)phosphanium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

benzylidene(dichloro)ruthenium;tris(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);dichloro-(3-phenylinden-1-ylidene)ruthenium;dichloro-[(2-propan-2-yloxyphenyl)methylidene]ruthenium;bis(tricyclohexylphosphanium)
CID 162285742
1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide;chloro-(3-phenylinden-1-ylidene)ruthenium;tricyclohexylphosphanium
CID 58568259
1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide;dichloro-(3-phenylinden-1-ylidene)ruthenium;pyridine
CID 59574881
acetonitrile;1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide;dichloro-(3-phenylinden-1-ylidene)ruthenium
CID 154612121
1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide;dichloro-(3-phenylinden-1-ylidene)ruthenium;triphenylphosphane
CID 11158877
bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);tris(dichloro-[(2-propan-2-yloxoniophenyl)methylidene]ruthenium);nitromethane;tricyclohexylphosphanium
CID 159920023
bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);dichloro(dideuterio)methane;bis(dichloro-(3-phenylinden-1-ylidene)ruthenium);bis(methoxy(diphenyl)phosphane)
CID 159955062
benzylidene(dichloro)ruthenium;1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide;methane;tricyclohexylphosphanium
CID 161205755
1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide;dichloro-(3-phenylinden-1-ylidene)ruthenium;quinolin-8-ylazanide
CID 154612126
pentakis(benzylidene(dichloro)ruthenium);1,3-bis[2,6-di(propan-2-yl)phenyl]imidazolidin-2-ide;1,3-bis(2,4,6-trimethylphenyl)-2H-imidazol-2-ide;bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);carbanide;carbanylium;bis(dichloro(3-methylbut-2-enylidene)ruthenium);dichloro-[(2-propan-2-yloxoniophenyl)methylidene]ruthenium;octakis(tricyclohexylphosphanium)
CID 161242154
1,3-bis[2,6-di(propan-2-yl)phenyl]-4,5-dihydroimidazole-1,3-diium;1,3-bis(2,4,6-trimethylphenyl)-2H-imidazol-2-ide;bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);cyclohexylphosphane;dichloro-[3-(1-methylidenepyridin-1-ium-2-id-2-yl)propylidene]ruthenium;tris(dichloro-(3-phenylinden-1-ylidene)ruthenium);bis(dichloro(phenylsulfanylmethylidene)ruthenium);tris(dicyclohexylphosphane);bis(tricyclohexylphosphanium)
CID 157080450
1,3-bis[2,6-di(propan-2-yl)phenyl]imidazolidin-2-ide;bis(dichloro-(3-phenylinden-1-ylidene)ruthenium);methane;propyl thiohypoiodite;tris(trimorpholin-4-ylphosphanium);hydrochloride
CID 157304219

Frequently Asked Questions

What is the IUPAC name of bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);hexakis(dichloro-(3-phenylinden-1-ylidene)ruthenium);dichloro-(3-phenyl-7-propan-2-yloxonioinden-1-ylidene)ruthenium;bis(1,3-dimethylimidazolidin-2-ide);bis(9-(2-methylpropyl)-9-phosphoniabicyclo[3.3.1]nonane);tris(tributylphosphanium);tris(tricyclohexylphosphanium);tri(propan-2-yloxy)phosphanium?
The IUPAC name of bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);hexakis(dichloro-(3-phenylinden-1-ylidene)ruthenium);dichloro-(3-phenyl-7-propan-2-yloxonioinden-1-ylidene)ruthenium;bis(1,3-dimethylimidazolidin-2-ide);bis(9-(2-methylpropyl)-9-phosphoniabicyclo[3.3.1]nonane);tris(tributylphosphanium);tris(tricyclohexylphosphanium);tri(propan-2-yloxy)phosphanium (CID 158025083) is bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);hexakis(dichloro-(3-phenylinden-1-ylidene)ruthenium);dichloro-(3-phenyl-7-propan-2-yloxonioinden-1-ylidene)ruthenium;bis(1,3-dimethylimidazolidin-2-ide);bis(9-(2-methylpropyl)-9-phosphoniabicyclo[3.3.1]nonane);tris(tributylphosphanium);tris(tricyclohexylphosphanium);tri(propan-2-yloxy)phosphanium.
What is the SMILES notation for bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);hexakis(dichloro-(3-phenylinden-1-ylidene)ruthenium);dichloro-(3-phenyl-7-propan-2-yloxonioinden-1-ylidene)ruthenium;bis(1,3-dimethylimidazolidin-2-ide);bis(9-(2-methylpropyl)-9-phosphoniabicyclo[3.3.1]nonane);tris(tributylphosphanium);tris(tricyclohexylphosphanium);tri(propan-2-yloxy)phosphanium?
The canonical SMILES for bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);hexakis(dichloro-(3-phenylinden-1-ylidene)ruthenium);dichloro-(3-phenyl-7-propan-2-yloxonioinden-1-ylidene)ruthenium;bis(1,3-dimethylimidazolidin-2-ide);bis(9-(2-methylpropyl)-9-phosphoniabicyclo[3.3.1]nonane);tris(tributylphosphanium);tris(tricyclohexylphosphanium);tri(propan-2-yloxy)phosphanium is C1CCC([PH+](C2CCCCC2)C2CCCCC2)CC1.C1CCC([PH+](C2CCCCC2)C2CCCCC2)CC1.C1CCC([PH+](C2CCCCC2)C2CCCCC2)CC1.CC(C)C[PH+]1C2CCCC1CCC2.CC(C)C[PH+]1C2CCCC1CCC2.CC(C)O[PH+](OC(C)C)OC(C)C.CC(C)[OH+]c1cccc2c1C(=[Ru](Cl)Cl)C=C2c1ccccc1.CCCC[PH+](CCCC)CCCC.CCCC[PH+](CCCC)CCCC.CCCC[PH+](CCCC)CCCC.CN1[CH-]N(C)CC1.CN1[CH-]N(C)CC1.Cc1cc(C)c(N2[CH-]N(c3c(C)cc(C)cc3C)CC2)c(C)c1.Cc1cc(C)c(N2[CH-]N(c3c(C)cc(C)cc3C)CC2)c(C)c1.Cl[Ru](Cl)=C1C=C(c2ccccc2)c2ccccc21.Cl[Ru](Cl)=C1C=C(c2ccccc2)c2ccccc21.Cl[Ru](Cl)=C1C=C(c2ccccc2)c2ccccc21.Cl[Ru](Cl)=C1C=C(c2ccccc2)c2ccccc21.Cl[Ru](Cl)=C1C=C(c2ccccc2)c2ccccc21.Cl[Ru](Cl)=C1C=C(c2ccccc2)c2ccccc21.
What is the InChIKey of bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);hexakis(dichloro-(3-phenylinden-1-ylidene)ruthenium);dichloro-(3-phenyl-7-propan-2-yloxonioinden-1-ylidene)ruthenium;bis(1,3-dimethylimidazolidin-2-ide);bis(9-(2-methylpropyl)-9-phosphoniabicyclo[3.3.1]nonane);tris(tributylphosphanium);tris(tricyclohexylphosphanium);tri(propan-2-yloxy)phosphanium?
The InChIKey is AULGWYXBFREDLC-UHFFFAOYSA-I. The full InChI is InChI=1S/2C21H27N2.C18H16O.3C18H33P.6C15H10.2C12H23P.3C12H27P.C9H22O3P.2C5H11N2.14ClH.7Ru/c2*1-14-9-16(3)20(17(4)10-14)22-7-8-23(13-22)21-18(5)11-15(2)12-19(21)6;1-13(2)19-18-10-6-9-16-15(11-12-17(16)18)14-7-4-3-5-8-14;3*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;6*1-2-6-12(7-3-1)15-11-10-13-8-4-5-9-14(13)15;2*1-10(2)9-13-11-5-3-6-12(13)8-4-7-11;3*1-4-7-10-13(11-8-5-2)12-9-6-3;1-7(2)10-13(11-8(3)4)12-9(5)6;2*1-6-3-4-7(2)5-6;;;;;;;;;;;;;;;;;;;;;/h2*9-13H,7-8H2,1-6H3;3-11,13H,1-2H3;3*16-18H,1-15H2;6*1-9,11H;2*10-12H,3-9H2,1-2H3;3*4-12H2,1-3H3;7-9,13H,1-6H3;2*5H,3-4H2,1-2H3;14*1H;;;;;;;/q2*-1;;;;;;;;;;;;;;;;+1;2*-1;;;;;;;;;;;;;;;7*+2/p-5.
What are the key properties of bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);hexakis(dichloro-(3-phenylinden-1-ylidene)ruthenium);dichloro-(3-phenyl-7-propan-2-yloxonioinden-1-ylidene)ruthenium;bis(1,3-dimethylimidazolidin-2-ide);bis(9-(2-methylpropyl)-9-phosphoniabicyclo[3.3.1]nonane);tris(tributylphosphanium);tris(tricyclohexylphosphanium);tri(propan-2-yloxy)phosphanium?
bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);hexakis(dichloro-(3-phenylinden-1-ylidene)ruthenium);dichloro-(3-phenyl-7-propan-2-yloxonioinden-1-ylidene)ruthenium;bis(1,3-dimethylimidazolidin-2-ide);bis(9-(2-methylpropyl)-9-phosphoniabicyclo[3.3.1]nonane);tris(tributylphosphanium);tris(tricyclohexylphosphanium);tri(propan-2-yloxy)phosphanium has a molecular weight of 5470.04 g/mol, XLogP of 86.17, 59 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for bis(1,3-bis(2,4,6-trimethylphenyl)imidazolidin-2-ide);hexakis(dichloro-(3-phenylinden-1-ylidene)ruthenium);dichloro-(3-phenyl-7-propan-2-yloxonioinden-1-ylidene)ruthenium;bis(1,3-dimethylimidazolidin-2-ide);bis(9-(2-methylpropyl)-9-phosphoniabicyclo[3.3.1]nonane);tris(tributylphosphanium);tris(tricyclohexylphosphanium);tri(propan-2-yloxy)phosphanium is sourced from PubChem (CID 158025083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).