potassium;[9-[5-(3-carboxypropoxy)-4-(dimethylamino)-2-methoxyphenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-[4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxobutoxy]-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-(4-ethoxy-4-oxobutoxy)-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;(2,5-dioxocyclopentyl) 2,2,2-trifluoroacetate;trichloride;hydroxide;hydrate

C103H123Cl3F3KN10O23 — CID 157376479

IUPACpotassium;[9-[5-(3-carboxypropoxy)-4-(dimethylamino)-2-methoxyphenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-[4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxobutoxy]-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-(4-ethoxy-4-oxobutoxy)-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;(2,5-dioxocyclopentyl) 2,2,2-trifluoroacetate;trichloride;hydroxide;hydrate
SMILESCCOC(=O)CCCOc1cc(-c2c3ccc(=[N+](C)C)cc-3oc3cc(N(C)C)ccc23)c(OC)cc1N(C)C.COc1cc(N(C)C)c(OCCCC(=O)O)cc1-c1c2ccc(=[N+](C)C)cc-2oc2cc(N(C)C)ccc12.COc1cc(N(C)C)c(OCCCC(=O)ON2C(=O)CCC2=O)cc1-c1c2ccc(=[N+](C)C)cc-2oc2cc(N(C)C)ccc12.O.O=C1CCC(=O)C1OC(=O)C(F)(F)F.[Cl-].[Cl-].[Cl-].[K+].[OH-]
InChIInChI=1S/C34H39N4O7.C32H40N3O5.C30H35N3O5.C7H5F3O4.3ClH.K.2H2O/c1-35(2)21-10-12-23-28(17-21)44-29-18-22(36(3)4)11-13-24(29)34(23)25-19-30(26(37(5)6)20-27(25)42-7)43-16-8-9-33(41)45-38-31(39)14-15-32(38)40;1-9-38-31(36)11-10-16-39-30-19-25(27(37-8)20-26(30)35(6)7)32-23-14-12-21(33(2)3)17-28(23)40-29-18-22(34(4)5)13-15-24(29)32;1-31(2)19-10-12-21-26(15-19)38-27-16-20(32(3)4)11-13-22(27)30(21)23-17-28(37-14-8-9-29(34)35)24(33(5)6)18-25(23)36-7;8-7(9,10)6(13)14-5-3(11)1-2-4(5)12;;;;;;/h10-13,17-20H,8-9,14-16H2,1-7H3;12-15,17-20H,9-11,16H2,1-8H3;10-13,15-18H,8-9,14H2,1-7H3;5H,1-2H2;3*1H;;2*1H2/q2*+1;;;;;;+1;;/p-3
InChIKeyWFZJZBYWABCGEF-UHFFFAOYSA-K
MW2071.61 g/mol
LogP1.27
Rot. Bonds30

About potassium;[9-[5-(3-carboxypropoxy)-4-(dimethylamino)-2-methoxyphenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-[4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxobutoxy]-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-(4-ethoxy-4-oxobutoxy)-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;(2,5-dioxocyclopentyl) 2,2,2-trifluoroacetate;trichloride;hydroxide;hydrate

potassium;[9-[5-(3-carboxypropoxy)-4-(dimethylamino)-2-methoxyphenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-[4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxobutoxy]-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-(4-ethoxy-4-oxobutoxy)-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;(2,5-dioxocyclopentyl) 2,2,2-trifluoroacetate;trichloride;hydroxide;hydrate (PubChem CID 157376479) has the molecular formula C103H123Cl3F3KN10O23 and a molecular weight of 2071.61 g/mol. Its IUPAC name is potassium;[9-[5-(3-carboxypropoxy)-4-(dimethylamino)-2-methoxyphenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-[4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxobutoxy]-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-(4-ethoxy-4-oxobutoxy)-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;(2,5-dioxocyclopentyl) 2,2,2-trifluoroacetate;trichloride;hydroxide;hydrate.

Molecular Properties

Compound Namepotassium;[9-[5-(3-carboxypropoxy)-4-(dimethylamino)-2-methoxyphenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-[4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxobutoxy]-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-(4-ethoxy-4-oxobutoxy)-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;(2,5-dioxocyclopentyl) 2,2,2-trifluoroacetate;trichloride;hydroxide;hydrate
PubChem CID157376479
Molecular FormulaC103H123Cl3F3KN10O23
Molecular Weight2071.61 g/mol
Exact Mass2068.74
IUPAC Namepotassium;[9-[5-(3-carboxypropoxy)-4-(dimethylamino)-2-methoxyphenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-[4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxobutoxy]-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-(4-ethoxy-4-oxobutoxy)-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;(2,5-dioxocyclopentyl) 2,2,2-trifluoroacetate;trichloride;hydroxide;hydrate
SMILESCCOC(=O)CCCOc1cc(-c2c3ccc(=[N+](C)C)cc-3oc3cc(N(C)C)ccc23)c(OC)cc1N(C)C.COc1cc(N(C)C)c(OCCCC(=O)O)cc1-c1c2ccc(=[N+](C)C)cc-2oc2cc(N(C)C)ccc12.COc1cc(N(C)C)c(OCCCC(=O)ON2C(=O)CCC2=O)cc1-c1c2ccc(=[N+](C)C)cc-2oc2cc(N(C)C)ccc12.O.O=C1CCC(=O)C1OC(=O)C(F)(F)F.[Cl-].[Cl-].[Cl-].[K+].[OH-]
InChIInChI=1S/C34H39N4O7.C32H40N3O5.C30H35N3O5.C7H5F3O4.3ClH.K.2H2O/c1-35(2)21-10-12-23-28(17-21)44-29-18-22(36(3)4)11-13-24(29)34(23)25-19-30(26(37(5)6)20-27(25)42-7)43-16-8-9-33(41)45-38-31(39)14-15-32(38)40;1-9-38-31(36)11-10-16-39-30-19-25(27(37-8)20-26(30)35(6)7)32-23-14-12-21(33(2)3)17-28(23)40-29-18-22(34(4)5)13-15-24(29)32;1-31(2)19-10-12-21-26(15-19)38-27-16-20(32(3)4)11-13-22(27)30(21)23-17-28(37-14-8-9-29(34)35)24(33(5)6)18-25(23)36-7;8-7(9,10)6(13)14-5-3(11)1-2-4(5)12;;;;;;/h10-13,17-20H,8-9,14-16H2,1-7H3;12-15,17-20H,9-11,16H2,1-8H3;10-13,15-18H,8-9,14H2,1-7H3;5H,1-2H2;3*1H;;2*1H2/q2*+1;;;;;;+1;;/p-3
InChIKeyWFZJZBYWABCGEF-UHFFFAOYSA-K
XLogP1.27
TPSA372.49 Ų
H-Bond Donors1
H-Bond Acceptors27
Rotatable Bonds30
Heavy Atoms143
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002071.61
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1027

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Analyze potassium;[9-[5-(3-carboxypropoxy)-4-(dimethylamino)-2-methoxyphenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-[4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxobutoxy]-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-(4-ethoxy-4-oxobutoxy)-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;(2,5-dioxocyclopentyl) 2,2,2-trifluoroacetate;trichloride;hydroxide;hydrate 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

potassium;[9-[5-(3-carboxypropoxy)-4-(dimethylamino)-2-methoxyphenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-(4-ethoxy-4-oxobutoxy)-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;1,3-dimethylidene-2-(2-methyloctyl)cyclopentane;(2,5-dioxopyrrolidin-1-yl) 2,2,2-trifluoroacetate;dichloride;hydroxide;hydrate
CID 160652134
3-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid;3-[2-[2-[2-[2-[2-[2-[2-[7-[4-[3-(dimethylamino)-6-dimethylazaniumylidenexanthen-9-yl]-N-ethyl-2,5-dimethoxyanilino]-4-oxoheptoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoate;[6-(dimethylamino)-9-[4-[[4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxobutyl]-ethylamino]-2,5-dimethoxyphenyl]xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-[[7-[2-[2-[2-[2-[2-[2-[2-[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4-oxoheptyl]-ethylamino]-2,5-dimethoxyphenyl]xanthen-3-ylidene]-dimethylazanium;(2,5-dioxopyrrolidin-1-yl) 2,2,2-trifluoroacetate;dichloride
CID 160513208
3-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid;3-[2-[2-[2-[2-[2-[2-[2-[7-[4-[3-(dimethylamino)-6-dimethylazaniumylidenexanthen-9-yl]-N-ethyl-2,5-dimethoxyanilino]-4-oxoheptoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoate;[6-(dimethylamino)-9-[4-[[4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxobutyl]-ethylamino]-2,5-dimethoxyphenyl]xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-[[7-[2-[2-[2-[2-[2-[2-[2-[3-(2,5-dioxopyrrolidin-1-yl)oxy-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4-oxoheptyl]-ethylamino]-2,5-dimethoxyphenyl]xanthen-3-ylidene]-dimethylazanium;(2,5-dioxopyrrolidin-1-yl) 2,2,2-trifluoroacetate;chloride;hydrochloride
CID 160913703
potassium;4-[4-[3-(dimethylamino)-6-dimethylazaniumylidenexanthen-9-yl]-N-ethyl-5-hydroxy-2-methoxyanilino]butanoate;[6-(dimethylamino)-9-[4-[[4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxobutyl]-ethylamino]-2-hydroxy-5-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-[ethyl-(4-methoxy-4-oxobutyl)amino]-2-hydroxy-5-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;(2,5-dioxopyrrolidin-1-yl) 2,2,2-trifluoroacetate;4-(N-ethyl-5-hydroxy-2-methoxyanilino)butanoic acid;N-ethyl-2-methoxy-5-methylaniline;methane;methyl 4-(N-ethyl-5-hydroxy-2-methoxyanilino)butanoate;methyl 4-(N-ethyl-2-methoxy-5-methylanilino)butanoate;methyl 4-iodobutanoate;dichloride;hydroxide;hydrochloride
CID 162184928
[9-[4-[[7-[2-[2-[2-[2-[2-[2-[2-(2-carboxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-4-oxoheptyl]-ethylamino]-2,5-dimethoxyphenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium
CID 160513209
[9-[4-[bis(2-methoxy-2-oxoethyl)amino]-3-[2-[2-[bis(2-methoxy-2-oxoethyl)amino]-4-[2-(2,5-dioxopyrrolidin-1-yl)oxy-2-oxoethyl]phenoxy]ethoxy]phenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium
CID 59831267
4-[4-[3-(dimethylamino)-6-dimethylazaniumylidenexanthen-9-yl]-N-ethyl-2,5-dimethoxyanilino]butanoate
CID 59839462
[9-[4-[3-carboxypropyl(ethyl)amino]-5-(dimethylamino)-2-methoxyphenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium;[9-chloro-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[5-(dimethylamino)-4-[[4-(2,5-dioxocyclopentyl)oxy-4-oxobutyl]-ethylamino]-2-methoxyphenyl]xanthen-3-id-3-yl]-methyl-methylideneazanium;[6-(dimethylamino)-9-[5-(dimethylamino)-4-[ethyl-(4-methoxy-4-oxobutyl)amino]-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;N-[2-(dimethylamino)-5-methoxyphenyl]acetamide;(2,5-dioxopyrrolidin-1-yl) 2,2,2-trifluoroacetate;2-N-ethyl-4-methoxy-1-N,1-N-dimethylbenzene-1,2-diamine;N-ethyl-N-propan-2-ylpropan-2-amine;4-methoxyaniline;4-methoxy-N,N-dimethylaniline;4-methoxy-N,N-dimethyl-2-nitrosoaniline;methyl 4-[2-(dimethylamino)-N-ethyl-5-methoxyanilino]butanoate;methyl 4-iodobutanoate;trichloride;hydrochloride
CID 159846808
[9-[2-(2-diazoacetyl)-5-[2-(2,5-dioxopyrrolidin-1-yl)oxy-2-oxoethyl]phenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium
CID 75628519
[9-[4-[5-(2,5-dihydroxypyrrol-1-yl)oxy-5-oxopentoxy]phenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium
CID 123764098
[9-[5-(dimethylamino)-4-[ethyl-(4-methoxy-4-oxobutyl)amino]-2-methoxyphenyl]-6-methylperoxyxanthen-3-ylidene]-dimethylazanium;ethane;methanamine
CID 143702494
[9-[4-[[4-[[6-(acetyloxymethoxy)-5-[bis[2-(acetyloxymethoxy)-2-oxoethyl]amino]-6-oxohexyl]amino]-4-oxobutyl]-ethylamino]-2-methoxy-5-methylphenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium
CID 118288647

Frequently Asked Questions

What is the IUPAC name of potassium;[9-[5-(3-carboxypropoxy)-4-(dimethylamino)-2-methoxyphenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-[4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxobutoxy]-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-(4-ethoxy-4-oxobutoxy)-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;(2,5-dioxocyclopentyl) 2,2,2-trifluoroacetate;trichloride;hydroxide;hydrate?
The IUPAC name of potassium;[9-[5-(3-carboxypropoxy)-4-(dimethylamino)-2-methoxyphenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-[4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxobutoxy]-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-(4-ethoxy-4-oxobutoxy)-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;(2,5-dioxocyclopentyl) 2,2,2-trifluoroacetate;trichloride;hydroxide;hydrate (CID 157376479) is potassium;[9-[5-(3-carboxypropoxy)-4-(dimethylamino)-2-methoxyphenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-[4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxobutoxy]-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-(4-ethoxy-4-oxobutoxy)-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;(2,5-dioxocyclopentyl) 2,2,2-trifluoroacetate;trichloride;hydroxide;hydrate.
What is the SMILES notation for potassium;[9-[5-(3-carboxypropoxy)-4-(dimethylamino)-2-methoxyphenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-[4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxobutoxy]-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-(4-ethoxy-4-oxobutoxy)-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;(2,5-dioxocyclopentyl) 2,2,2-trifluoroacetate;trichloride;hydroxide;hydrate?
The canonical SMILES for potassium;[9-[5-(3-carboxypropoxy)-4-(dimethylamino)-2-methoxyphenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-[4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxobutoxy]-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-(4-ethoxy-4-oxobutoxy)-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;(2,5-dioxocyclopentyl) 2,2,2-trifluoroacetate;trichloride;hydroxide;hydrate is CCOC(=O)CCCOc1cc(-c2c3ccc(=[N+](C)C)cc-3oc3cc(N(C)C)ccc23)c(OC)cc1N(C)C.COc1cc(N(C)C)c(OCCCC(=O)O)cc1-c1c2ccc(=[N+](C)C)cc-2oc2cc(N(C)C)ccc12.COc1cc(N(C)C)c(OCCCC(=O)ON2C(=O)CCC2=O)cc1-c1c2ccc(=[N+](C)C)cc-2oc2cc(N(C)C)ccc12.O.O=C1CCC(=O)C1OC(=O)C(F)(F)F.[Cl-].[Cl-].[Cl-].[K+].[OH-].
What is the InChIKey of potassium;[9-[5-(3-carboxypropoxy)-4-(dimethylamino)-2-methoxyphenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-[4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxobutoxy]-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-(4-ethoxy-4-oxobutoxy)-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;(2,5-dioxocyclopentyl) 2,2,2-trifluoroacetate;trichloride;hydroxide;hydrate?
The InChIKey is WFZJZBYWABCGEF-UHFFFAOYSA-K. The full InChI is InChI=1S/C34H39N4O7.C32H40N3O5.C30H35N3O5.C7H5F3O4.3ClH.K.2H2O/c1-35(2)21-10-12-23-28(17-21)44-29-18-22(36(3)4)11-13-24(29)34(23)25-19-30(26(37(5)6)20-27(25)42-7)43-16-8-9-33(41)45-38-31(39)14-15-32(38)40;1-9-38-31(36)11-10-16-39-30-19-25(27(37-8)20-26(30)35(6)7)32-23-14-12-21(33(2)3)17-28(23)40-29-18-22(34(4)5)13-15-24(29)32;1-31(2)19-10-12-21-26(15-19)38-27-16-20(32(3)4)11-13-22(27)30(21)23-17-28(37-14-8-9-29(34)35)24(33(5)6)18-25(23)36-7;8-7(9,10)6(13)14-5-3(11)1-2-4(5)12;;;;;;/h10-13,17-20H,8-9,14-16H2,1-7H3;12-15,17-20H,9-11,16H2,1-8H3;10-13,15-18H,8-9,14H2,1-7H3;5H,1-2H2;3*1H;;2*1H2/q2*+1;;;;;;+1;;/p-3.
What are the key properties of potassium;[9-[5-(3-carboxypropoxy)-4-(dimethylamino)-2-methoxyphenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-[4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxobutoxy]-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-(4-ethoxy-4-oxobutoxy)-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;(2,5-dioxocyclopentyl) 2,2,2-trifluoroacetate;trichloride;hydroxide;hydrate?
potassium;[9-[5-(3-carboxypropoxy)-4-(dimethylamino)-2-methoxyphenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-[4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxobutoxy]-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-(4-ethoxy-4-oxobutoxy)-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;(2,5-dioxocyclopentyl) 2,2,2-trifluoroacetate;trichloride;hydroxide;hydrate has a molecular weight of 2071.61 g/mol, XLogP of 1.27, 30 rotatable bonds, 1 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;[9-[5-(3-carboxypropoxy)-4-(dimethylamino)-2-methoxyphenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-[4-(2,5-dioxopyrrolidin-1-yl)oxy-4-oxobutoxy]-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;[6-(dimethylamino)-9-[4-(dimethylamino)-5-(4-ethoxy-4-oxobutoxy)-2-methoxyphenyl]xanthen-3-ylidene]-dimethylazanium;(2,5-dioxocyclopentyl) 2,2,2-trifluoroacetate;trichloride;hydroxide;hydrate is sourced from PubChem (CID 157376479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).