dodecakis(carbon dioxide);[(Z)-1-[4-(2,4-dihexoxyphenyl)-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]-3-iminobut-1-enyl]azanide;hydroxymethoxymethoxymethanol;4-[3-(methoxymethyl)thiophen-2-yl]-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;4-(2-methylphenyl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(4-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine);5-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;pentakis(2-(6-pyridin-2-yl-2-pyridinyl)pyridine-4-carboxylic acid);2-(6-pyridin-2-yl-2-pyridinyl)-1,3,5-triazine;hexakis(ruthenium(2+));pentaisothiocyanate

C259H243F18N45O41Ru6S9 — CID 159827543

IUPACdodecakis(carbon dioxide);[(Z)-1-[4-(2,4-dihexoxyphenyl)-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]-3-iminobut-1-enyl]azanide;hydroxymethoxymethoxymethanol;4-[3-(methoxymethyl)thiophen-2-yl]-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;4-(2-methylphenyl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(4-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine);5-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;pentakis(2-(6-pyridin-2-yl-2-pyridinyl)pyridine-4-carboxylic acid);2-(6-pyridin-2-yl-2-pyridinyl)-1,3,5-triazine;hexakis(ruthenium(2+));pentaisothiocyanate
SMILESCCCCCCCCCCCCCCCc1ccsc1-c1ccc(-c2cc(C(F)(F)F)n[n-]2)nc1.CCCCCCCCCCCCCCCc1ccsc1-c1ccnc(-c2cc(C(F)(F)F)n[n-]2)c1.CCCCCCCCCCCCCCCc1ccsc1-c1ccnc(-c2cc(C(F)(F)F)n[n-]2)c1.COCc1ccsc1-c1ccnc(-c2cc(C(F)(F)F)n[n-]2)c1.Cc1ccccc1-c1ccnc(-c2cc(C(F)(F)F)n[n-]2)c1.O=C(O)c1ccnc(-c2cccc(-c3ccccn3)n2)c1.O=C(O)c1ccnc(-c2cccc(-c3ccccn3)n2)c1.O=C(O)c1ccnc(-c2cccc(-c3ccccn3)n2)c1.O=C(O)c1ccnc(-c2cccc(-c3ccccn3)n2)c1.O=C(O)c1ccnc(-c2cccc(-c3ccccn3)n2)c1.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.OCOCOCO.[H]/N=C(C)/C=C(\[NH-])c1cc(-c2ccc(OCCCCCC)cc2OCCCCCC)cc(-c2cc(C(F)(F)F)n[n-]2)n1.[N-]=C=S.[N-]=C=S.[N-]=C=S.[N-]=C=S.[N-]=C=S.[Ru+2].[Ru+2].[Ru+2].[Ru+2].[Ru+2].[Ru+2].c1ccc(-c2cccc(-c3ncncn3)n2)nc1
InChIInChI=1S/C31H38F3N5O2.3C28H37F3N3S.C16H11F3N3.5C16H11N3O2.C15H11F3N3OS.C13H9N5.C3H8O4.5CNS.12CO2.6Ru/c1-4-6-8-10-14-40-23-12-13-24(29(19-23)41-15-11-9-7-5-2)22-17-26(25(36)16-21(3)35)37-27(18-22)28-20-30(39-38-28)31(32,33)34;2*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22-17-19-35-27(22)23-16-18-32-24(20-23)25-21-26(34-33-25)28(29,30)31;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22-18-19-35-27(22)23-16-17-24(32-21-23)25-20-26(34-33-25)28(29,30)31;1-10-4-2-3-5-12(10)11-6-7-20-13(8-11)14-9-15(22-21-14)16(17,18)19;5*20-16(21)11-7-9-18-15(10-11)14-6-3-5-13(19-14)12-4-1-2-8-17-12;1-22-8-10-3-5-23-14(10)9-2-4-19-11(6-9)12-7-13(21-20-12)15(16,17)18;1-2-7-15-10(4-1)11-5-3-6-12(18-11)13-16-8-14-9-17-13;4-1-6-3-7-2-5;17*2-1-3;;;;;;/h12-13,16-20,35-36H,4-11,14-15H2,1-3H3;3*16-21H,2-15H2,1H3;2-9H,1H3;5*1-10H,(H,20,21);2-7H,8H2,1H3;1-9H;4-5H,1-3H2;;;;;;;;;;;;;;;;;;;;;;;/q-2;4*-1;;;;;;-1;;;5*-1;;;;;;;;;;;;;6*+2/b25-16-,35-21+;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
InChIKeyNNAPHMOHPTVMEC-NHQAMWOUSA-N
MW5879.05 g/mol
LogP57.34
Rot. Bonds91

About dodecakis(carbon dioxide);[(Z)-1-[4-(2,4-dihexoxyphenyl)-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]-3-iminobut-1-enyl]azanide;hydroxymethoxymethoxymethanol;4-[3-(methoxymethyl)thiophen-2-yl]-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;4-(2-methylphenyl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(4-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine);5-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;pentakis(2-(6-pyridin-2-yl-2-pyridinyl)pyridine-4-carboxylic acid);2-(6-pyridin-2-yl-2-pyridinyl)-1,3,5-triazine;hexakis(ruthenium(2+));pentaisothiocyanate

dodecakis(carbon dioxide);[(Z)-1-[4-(2,4-dihexoxyphenyl)-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]-3-iminobut-1-enyl]azanide;hydroxymethoxymethoxymethanol;4-[3-(methoxymethyl)thiophen-2-yl]-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;4-(2-methylphenyl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(4-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine);5-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;pentakis(2-(6-pyridin-2-yl-2-pyridinyl)pyridine-4-carboxylic acid);2-(6-pyridin-2-yl-2-pyridinyl)-1,3,5-triazine;hexakis(ruthenium(2+));pentaisothiocyanate (PubChem CID 159827543) has the molecular formula C259H243F18N45O41Ru6S9 and a molecular weight of 5879.05 g/mol. Its IUPAC name is dodecakis(carbon dioxide);[(Z)-1-[4-(2,4-dihexoxyphenyl)-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]-3-iminobut-1-enyl]azanide;hydroxymethoxymethoxymethanol;4-[3-(methoxymethyl)thiophen-2-yl]-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;4-(2-methylphenyl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(4-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine);5-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;pentakis(2-(6-pyridin-2-yl-2-pyridinyl)pyridine-4-carboxylic acid);2-(6-pyridin-2-yl-2-pyridinyl)-1,3,5-triazine;hexakis(ruthenium(2+));pentaisothiocyanate.

Molecular Properties

Compound Namedodecakis(carbon dioxide);[(Z)-1-[4-(2,4-dihexoxyphenyl)-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]-3-iminobut-1-enyl]azanide;hydroxymethoxymethoxymethanol;4-[3-(methoxymethyl)thiophen-2-yl]-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;4-(2-methylphenyl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(4-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine);5-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;pentakis(2-(6-pyridin-2-yl-2-pyridinyl)pyridine-4-carboxylic acid);2-(6-pyridin-2-yl-2-pyridinyl)-1,3,5-triazine;hexakis(ruthenium(2+));pentaisothiocyanate
PubChem CID159827543
Molecular FormulaC259H243F18N45O41Ru6S9
Molecular Weight5879.05 g/mol
Exact Mass5879.98
IUPAC Namedodecakis(carbon dioxide);[(Z)-1-[4-(2,4-dihexoxyphenyl)-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]-3-iminobut-1-enyl]azanide;hydroxymethoxymethoxymethanol;4-[3-(methoxymethyl)thiophen-2-yl]-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;4-(2-methylphenyl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(4-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine);5-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;pentakis(2-(6-pyridin-2-yl-2-pyridinyl)pyridine-4-carboxylic acid);2-(6-pyridin-2-yl-2-pyridinyl)-1,3,5-triazine;hexakis(ruthenium(2+));pentaisothiocyanate
SMILESCCCCCCCCCCCCCCCc1ccsc1-c1ccc(-c2cc(C(F)(F)F)n[n-]2)nc1.CCCCCCCCCCCCCCCc1ccsc1-c1ccnc(-c2cc(C(F)(F)F)n[n-]2)c1.CCCCCCCCCCCCCCCc1ccsc1-c1ccnc(-c2cc(C(F)(F)F)n[n-]2)c1.COCc1ccsc1-c1ccnc(-c2cc(C(F)(F)F)n[n-]2)c1.Cc1ccccc1-c1ccnc(-c2cc(C(F)(F)F)n[n-]2)c1.O=C(O)c1ccnc(-c2cccc(-c3ccccn3)n2)c1.O=C(O)c1ccnc(-c2cccc(-c3ccccn3)n2)c1.O=C(O)c1ccnc(-c2cccc(-c3ccccn3)n2)c1.O=C(O)c1ccnc(-c2cccc(-c3ccccn3)n2)c1.O=C(O)c1ccnc(-c2cccc(-c3ccccn3)n2)c1.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.OCOCOCO.[H]/N=C(C)/C=C(\[NH-])c1cc(-c2ccc(OCCCCCC)cc2OCCCCCC)cc(-c2cc(C(F)(F)F)n[n-]2)n1.[N-]=C=S.[N-]=C=S.[N-]=C=S.[N-]=C=S.[N-]=C=S.[Ru+2].[Ru+2].[Ru+2].[Ru+2].[Ru+2].[Ru+2].c1ccc(-c2cccc(-c3ncncn3)n2)nc1
InChIInChI=1S/C31H38F3N5O2.3C28H37F3N3S.C16H11F3N3.5C16H11N3O2.C15H11F3N3OS.C13H9N5.C3H8O4.5CNS.12CO2.6Ru/c1-4-6-8-10-14-40-23-12-13-24(29(19-23)41-15-11-9-7-5-2)22-17-26(25(36)16-21(3)35)37-27(18-22)28-20-30(39-38-28)31(32,33)34;2*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22-17-19-35-27(22)23-16-18-32-24(20-23)25-21-26(34-33-25)28(29,30)31;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22-18-19-35-27(22)23-16-17-24(32-21-23)25-20-26(34-33-25)28(29,30)31;1-10-4-2-3-5-12(10)11-6-7-20-13(8-11)14-9-15(22-21-14)16(17,18)19;5*20-16(21)11-7-9-18-15(10-11)14-6-3-5-13(19-14)12-4-1-2-8-17-12;1-22-8-10-3-5-23-14(10)9-2-4-19-11(6-9)12-7-13(21-20-12)15(16,17)18;1-2-7-15-10(4-1)11-5-3-6-12(18-11)13-16-8-14-9-17-13;4-1-6-3-7-2-5;17*2-1-3;;;;;;/h12-13,16-20,35-36H,4-11,14-15H2,1-3H3;3*16-21H,2-15H2,1H3;2-9H,1H3;5*1-10H,(H,20,21);2-7H,8H2,1H3;1-9H;4-5H,1-3H2;;;;;;;;;;;;;;;;;;;;;;;/q-2;4*-1;;;;;;-1;;;5*-1;;;;;;;;;;;;;6*+2/b25-16-,35-21+;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;
InChIKeyNNAPHMOHPTVMEC-NHQAMWOUSA-N
XLogP57.34
TPSA1339.02 Ų
H-Bond Donors8
H-Bond Acceptors78
Rotatable Bonds91
Heavy Atoms378
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005879.05
LogP ≤ 557.34
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1078

Analyze dodecakis(carbon dioxide);[(Z)-1-[4-(2,4-dihexoxyphenyl)-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]-3-iminobut-1-enyl]azanide;hydroxymethoxymethoxymethanol;4-[3-(methoxymethyl)thiophen-2-yl]-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;4-(2-methylphenyl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(4-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine);5-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;pentakis(2-(6-pyridin-2-yl-2-pyridinyl)pyridine-4-carboxylic acid);2-(6-pyridin-2-yl-2-pyridinyl)-1,3,5-triazine;hexakis(ruthenium(2+));pentaisothiocyanate with MolForge

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Related Compounds

4-[(E)-2-[5-(2,4-dimethoxyphenyl)-2,3-dihydrothieno[3,4-b][1,4]dioxin-7-yl]ethenyl]-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;2-(6-pyridin-2-yl-2-pyridinyl)pyridine-4-carboxylic acid;ruthenium(2+);isothiocyanate
CID 140701055
5-(5-Butylthiophen-2-yl)-2-[5-[3-methyl-5-(trifluoromethyl)phenyl]-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridine;5-(5-butylthiophen-2-yl)-2-[3-(2,3,4,5,6-pentafluorophenyl)pyrazol-1-id-5-yl]pyridine;5-(3,5-dimethylthiophen-2-yl)-2-[3-(2,3,4,5-tetrafluorophenyl)pyrazol-1-id-5-yl]pyridine;2-[3-(2-fluoropropan-2-yl)pyrazol-1-id-5-yl]-5-(5-methylthiophen-2-yl)pyridine;tetrakis(2-[4-formyloxy-6-(4-formyloxy-2-pyridinyl)-2-pyridinyl]pyridine-4-carboxylic acid);tetrakis(ruthenium(2+));tetraisothiocyanate
CID 157180542
bis(carbon dioxide);chlororuthenium;2-[3-(difluoromethyl)pyrazol-1-id-5-yl]-4-(5-hexylthiophen-2-yl)-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-1,3,5-triazine;[2-[4-formyloxy-6-[5-[2-(4-pentylphenyl)ethynyl]-2-pyridinyl]-2-pyridinyl]-4-pyridinyl] formate;methane;4-methyl-2-[4-[(E)-2-(4-methylphenyl)ethenyl]-2-pyridinyl]-6-pyridin-2-ylpyridine;propane;pyridine;2-[6-[6-pyridin-2-yl-4-[(E)-2-(4-tridecylphenyl)ethenyl]-2-pyridinyl]-2-pyridinyl]pyridine-4-carboxylic acid;ruthenium(2+);ruthenium(3+);chloride;triisothiocyanate
CID 157629485
hexakis(carbon dioxide);[(Z)-1-[4-(2,4-dihexoxyphenyl)-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]-3-iminobut-1-enyl]azanide;4-(3,6-dihexylthieno[2,3-f][1]benzothiol-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;2-(4-fluoro-2-pyridinyl)-6-pyridin-2-ylpyridine;bis(2-(6-pyridin-2-yl-2-pyridinyl)pyridine-4-carboxylic acid);tris(ruthenium(2+));2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-4-(5,9,10-trihexyl-3,7,11-trithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl)pyridine;diisothiocyanate
CID 157742411
hexakis(carbon dioxide);4-[(E)-2-(3,5-dihexylthiophen-2-yl)ethenyl]-2-[3-(3,5-dihexylthiophen-2-yl)pyrazol-1-id-5-yl]pyridine;[(Z)-1-[4-(2,6-diphenoxyphenyl)-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]-3-iminobut-1-enyl]azanide;tris(2-(6-pyridin-2-yl-2-pyridinyl)pyridine-4-carboxylic acid);tris(ruthenium(2+));2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-4-(2,3,6-trihexylthieno[3,2-b]thiophen-5-yl)pyridine;diisothiocyanate
CID 157980083
CID 157991836
CID 157991836
4-(7-butyl-3-hexyl-2-benzothiophen-1-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;octakis(carbon dioxide);[(Z)-1-[4-(2,4-dihexoxyphenyl)-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]-3-iminobut-1-enyl]azanide;[(Z)-1-[4-[4-(2-ethylhexoxy)-2-(2-ethylpentoxy)phenyl]-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]-3-iminobut-1-enyl]azanide;[(Z)-1-[4-(2-hexoxy-6-pentoxyphenyl)-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]-3-iminobut-1-enyl]azanide;2-(6-pyridin-2-yl-2-pyridinyl)pyrazine;tris(2-(6-pyridin-2-yl-2-pyridinyl)pyridine-4-carboxylic acid);tetrakis(ruthenium(2+));isothiocyanate
CID 157992714
CID 158161972
CID 158161972
octakis(carbon dioxide);4-[(E)-2-[5-(2,4-dimethoxyphenyl)-2,3-dihydrothieno[3,4-b][1,4]dioxin-7-yl]ethenyl]-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;4-(5-ethylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;4-[(E)-hept-1-enyl]-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;tetrakis(2-(6-pyridin-2-yl-2-pyridinyl)pyridine-4-carboxylic acid);tetrakis(ruthenium(2+));2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;tetraisothiocyanate
CID 158195245
[(Z)-1-[4-[4,5-bis(4-hexoxy-2-methylphenyl)thiophen-2-yl]-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]-3-iminobut-1-enyl]azanide;dodecakis(carbon dioxide);[(Z)-1-[4-[3-hexoxy-4-(2-hexoxy-6-methylphenyl)-5-methylphenyl]-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]-3-iminobut-1-enyl]azanide;5-(2-hexoxy-6-methylphenyl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;[(Z)-1-[4-[2-(hydroxymethyl)-6-methoxyphenyl]-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]-3-iminobut-1-enyl]azanide;[(Z)-3-imino-1-[4-(2-tributylsilyloxyphenyl)-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]but-1-enyl]azanide;[(Z)-3-imino-1-[6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-4-(3-trimethylsilylphenyl)-2-pyridinyl]but-1-enyl]azanide;hexakis(2-(6-pyridin-2-yl-2-pyridinyl)pyridine-4-carboxylic acid);hexakis(ruthenium(2+));isothiocyanate
CID 158256529
carbon dioxide;(E)-3-[2-[4-[(Z)-2-cyanoethenyl]-2-pyridinyl]-6-pyridin-2-yl-4-pyridinyl]-2-isocyanoprop-2-enoic acid;bis(2-(3,5-difluorobenzene-6-id-1-yl)-4-(3-hexylthiophen-2-yl)pyridine);heptakis((E)-3-(2,6-dipyridin-2-yl-4-pyridinyl)-2-isocyanoprop-2-enoic acid);5-(2-hexoxy-6-methylphenyl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;4-[(E)-2-(5-hexylthiophen-2-yl)ethenyl]-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;4-(3-hexylthiophen-2-yl)-2-(5-methyl-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine;4-(3-hexylthiophen-2-yl)-2-pyrrol-1-id-2-ylpyridine;4-(3-hexylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;5-(3-hexylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;octakis(ruthenium(2+));octaisothiocyanate
CID 159319458
CID 159470803
CID 159470803

Frequently Asked Questions

What is the IUPAC name of dodecakis(carbon dioxide);[(Z)-1-[4-(2,4-dihexoxyphenyl)-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]-3-iminobut-1-enyl]azanide;hydroxymethoxymethoxymethanol;4-[3-(methoxymethyl)thiophen-2-yl]-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;4-(2-methylphenyl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(4-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine);5-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;pentakis(2-(6-pyridin-2-yl-2-pyridinyl)pyridine-4-carboxylic acid);2-(6-pyridin-2-yl-2-pyridinyl)-1,3,5-triazine;hexakis(ruthenium(2+));pentaisothiocyanate?
The IUPAC name of dodecakis(carbon dioxide);[(Z)-1-[4-(2,4-dihexoxyphenyl)-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]-3-iminobut-1-enyl]azanide;hydroxymethoxymethoxymethanol;4-[3-(methoxymethyl)thiophen-2-yl]-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;4-(2-methylphenyl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(4-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine);5-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;pentakis(2-(6-pyridin-2-yl-2-pyridinyl)pyridine-4-carboxylic acid);2-(6-pyridin-2-yl-2-pyridinyl)-1,3,5-triazine;hexakis(ruthenium(2+));pentaisothiocyanate (CID 159827543) is dodecakis(carbon dioxide);[(Z)-1-[4-(2,4-dihexoxyphenyl)-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]-3-iminobut-1-enyl]azanide;hydroxymethoxymethoxymethanol;4-[3-(methoxymethyl)thiophen-2-yl]-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;4-(2-methylphenyl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(4-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine);5-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;pentakis(2-(6-pyridin-2-yl-2-pyridinyl)pyridine-4-carboxylic acid);2-(6-pyridin-2-yl-2-pyridinyl)-1,3,5-triazine;hexakis(ruthenium(2+));pentaisothiocyanate.
What is the SMILES notation for dodecakis(carbon dioxide);[(Z)-1-[4-(2,4-dihexoxyphenyl)-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]-3-iminobut-1-enyl]azanide;hydroxymethoxymethoxymethanol;4-[3-(methoxymethyl)thiophen-2-yl]-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;4-(2-methylphenyl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(4-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine);5-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;pentakis(2-(6-pyridin-2-yl-2-pyridinyl)pyridine-4-carboxylic acid);2-(6-pyridin-2-yl-2-pyridinyl)-1,3,5-triazine;hexakis(ruthenium(2+));pentaisothiocyanate?
The canonical SMILES for dodecakis(carbon dioxide);[(Z)-1-[4-(2,4-dihexoxyphenyl)-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]-3-iminobut-1-enyl]azanide;hydroxymethoxymethoxymethanol;4-[3-(methoxymethyl)thiophen-2-yl]-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;4-(2-methylphenyl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(4-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine);5-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;pentakis(2-(6-pyridin-2-yl-2-pyridinyl)pyridine-4-carboxylic acid);2-(6-pyridin-2-yl-2-pyridinyl)-1,3,5-triazine;hexakis(ruthenium(2+));pentaisothiocyanate is CCCCCCCCCCCCCCCc1ccsc1-c1ccc(-c2cc(C(F)(F)F)n[n-]2)nc1.CCCCCCCCCCCCCCCc1ccsc1-c1ccnc(-c2cc(C(F)(F)F)n[n-]2)c1.CCCCCCCCCCCCCCCc1ccsc1-c1ccnc(-c2cc(C(F)(F)F)n[n-]2)c1.COCc1ccsc1-c1ccnc(-c2cc(C(F)(F)F)n[n-]2)c1.Cc1ccccc1-c1ccnc(-c2cc(C(F)(F)F)n[n-]2)c1.O=C(O)c1ccnc(-c2cccc(-c3ccccn3)n2)c1.O=C(O)c1ccnc(-c2cccc(-c3ccccn3)n2)c1.O=C(O)c1ccnc(-c2cccc(-c3ccccn3)n2)c1.O=C(O)c1ccnc(-c2cccc(-c3ccccn3)n2)c1.O=C(O)c1ccnc(-c2cccc(-c3ccccn3)n2)c1.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.OCOCOCO.[H]/N=C(C)/C=C(\[NH-])c1cc(-c2ccc(OCCCCCC)cc2OCCCCCC)cc(-c2cc(C(F)(F)F)n[n-]2)n1.[N-]=C=S.[N-]=C=S.[N-]=C=S.[N-]=C=S.[N-]=C=S.[Ru+2].[Ru+2].[Ru+2].[Ru+2].[Ru+2].[Ru+2].c1ccc(-c2cccc(-c3ncncn3)n2)nc1.
What is the InChIKey of dodecakis(carbon dioxide);[(Z)-1-[4-(2,4-dihexoxyphenyl)-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]-3-iminobut-1-enyl]azanide;hydroxymethoxymethoxymethanol;4-[3-(methoxymethyl)thiophen-2-yl]-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;4-(2-methylphenyl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(4-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine);5-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;pentakis(2-(6-pyridin-2-yl-2-pyridinyl)pyridine-4-carboxylic acid);2-(6-pyridin-2-yl-2-pyridinyl)-1,3,5-triazine;hexakis(ruthenium(2+));pentaisothiocyanate?
The InChIKey is NNAPHMOHPTVMEC-NHQAMWOUSA-N. The full InChI is InChI=1S/C31H38F3N5O2.3C28H37F3N3S.C16H11F3N3.5C16H11N3O2.C15H11F3N3OS.C13H9N5.C3H8O4.5CNS.12CO2.6Ru/c1-4-6-8-10-14-40-23-12-13-24(29(19-23)41-15-11-9-7-5-2)22-17-26(25(36)16-21(3)35)37-27(18-22)28-20-30(39-38-28)31(32,33)34;2*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22-17-19-35-27(22)23-16-18-32-24(20-23)25-21-26(34-33-25)28(29,30)31;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22-18-19-35-27(22)23-16-17-24(32-21-23)25-20-26(34-33-25)28(29,30)31;1-10-4-2-3-5-12(10)11-6-7-20-13(8-11)14-9-15(22-21-14)16(17,18)19;5*20-16(21)11-7-9-18-15(10-11)14-6-3-5-13(19-14)12-4-1-2-8-17-12;1-22-8-10-3-5-23-14(10)9-2-4-19-11(6-9)12-7-13(21-20-12)15(16,17)18;1-2-7-15-10(4-1)11-5-3-6-12(18-11)13-16-8-14-9-17-13;4-1-6-3-7-2-5;17*2-1-3;;;;;;/h12-13,16-20,35-36H,4-11,14-15H2,1-3H3;3*16-21H,2-15H2,1H3;2-9H,1H3;5*1-10H,(H,20,21);2-7H,8H2,1H3;1-9H;4-5H,1-3H2;;;;;;;;;;;;;;;;;;;;;;;/q-2;4*-1;;;;;;-1;;;5*-1;;;;;;;;;;;;;6*+2/b25-16-,35-21+;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;.
What are the key properties of dodecakis(carbon dioxide);[(Z)-1-[4-(2,4-dihexoxyphenyl)-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]-3-iminobut-1-enyl]azanide;hydroxymethoxymethoxymethanol;4-[3-(methoxymethyl)thiophen-2-yl]-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;4-(2-methylphenyl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(4-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine);5-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;pentakis(2-(6-pyridin-2-yl-2-pyridinyl)pyridine-4-carboxylic acid);2-(6-pyridin-2-yl-2-pyridinyl)-1,3,5-triazine;hexakis(ruthenium(2+));pentaisothiocyanate?
dodecakis(carbon dioxide);[(Z)-1-[4-(2,4-dihexoxyphenyl)-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]-3-iminobut-1-enyl]azanide;hydroxymethoxymethoxymethanol;4-[3-(methoxymethyl)thiophen-2-yl]-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;4-(2-methylphenyl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(4-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine);5-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;pentakis(2-(6-pyridin-2-yl-2-pyridinyl)pyridine-4-carboxylic acid);2-(6-pyridin-2-yl-2-pyridinyl)-1,3,5-triazine;hexakis(ruthenium(2+));pentaisothiocyanate has a molecular weight of 5879.05 g/mol, XLogP of 57.34, 91 rotatable bonds, 8 hydrogen bond donors, and 78 hydrogen bond acceptors.
Where does this data come from?
All data for dodecakis(carbon dioxide);[(Z)-1-[4-(2,4-dihexoxyphenyl)-6-[3-(trifluoromethyl)pyrazol-1-id-5-yl]-2-pyridinyl]-3-iminobut-1-enyl]azanide;hydroxymethoxymethoxymethanol;4-[3-(methoxymethyl)thiophen-2-yl]-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;4-(2-methylphenyl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;bis(4-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine);5-(3-pentadecylthiophen-2-yl)-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;pentakis(2-(6-pyridin-2-yl-2-pyridinyl)pyridine-4-carboxylic acid);2-(6-pyridin-2-yl-2-pyridinyl)-1,3,5-triazine;hexakis(ruthenium(2+));pentaisothiocyanate is sourced from PubChem (CID 159827543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).