dipotassium;S-[2-[2-[4-[[2-[[1-[2-(2-acetylsulfanylethoxy)ethyl]-2H-triazol-1-ium-4-yl]methoxymethyl]-3-[[1-[2-(2-acetylsulfanylethoxy)ethyl]triazol-4-yl]methoxy]-2-[(2-phenoxyacetyl)amino]propoxy]methyl]triazol-1-yl]ethoxy]ethyl] ethanethioate;2-amino-2-(hydroxymethyl)propane-1,3-diol;S-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;N-[1,3-bis(prop-2-ynoxy)-2-(prop-2-ynoxymethyl)propan-2-yl]-2-phenoxyacetamide;3-bromoprop-1-yne;N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-phenoxyacetamide;di(imidazol-1-yl)methanone;hydride;S-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;oxido formate;2-phenoxyacetyl chloride;hydrate

C119H175BrClK2N20O42S5+ — CID 159464828

IUPACdipotassium;S-[2-[2-[4-[[2-[[1-[2-(2-acetylsulfanylethoxy)ethyl]-2H-triazol-1-ium-4-yl]methoxymethyl]-3-[[1-[2-(2-acetylsulfanylethoxy)ethyl]triazol-4-yl]methoxy]-2-[(2-phenoxyacetyl)amino]propoxy]methyl]triazol-1-yl]ethoxy]ethyl] ethanethioate;2-amino-2-(hydroxymethyl)propane-1,3-diol;S-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;N-[1,3-bis(prop-2-ynoxy)-2-(prop-2-ynoxymethyl)propan-2-yl]-2-phenoxyacetamide;3-bromoprop-1-yne;N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-phenoxyacetamide;di(imidazol-1-yl)methanone;hydride;S-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;oxido formate;2-phenoxyacetyl chloride;hydrate
SMILESC#CCBr.C#CCOCC(COCC#C)(COCC#C)NC(=O)COc1ccccc1.CC(=O)SCCOCCOCCOCCOCCN=[N+]=[N-].CC(=O)SCCOCCOCCOCCOCCO.CC(=O)SCCOCCn1cc(COCC(COCc2cn(CCOCCSC(C)=O)nn2)(COCc2c[n+](CCOCCSC(C)=O)[nH]n2)NC(=O)COc2ccccc2)nn1.NC(CO)(CO)CO.O.O=C(COc1ccccc1)NC(CO)(CO)CO.O=C(Cl)COc1ccccc1.O=C(n1ccnc1)n1ccnc1.O=CO[O-].[H-].[K+].[K+]
InChIInChI=1S/C39H56N10O11S3.C21H23NO5.C12H23N3O5S.C12H17NO5.C12H24O6S.C8H7ClO2.C7H6N4O.C4H11NO3.C3H3Br.CH2O3.2K.H2O.H/c1-31(50)61-18-15-54-12-9-47-21-34(41-44-47)24-57-28-39(40-38(53)27-60-37-7-5-4-6-8-37,29-58-25-35-22-48(45-42-35)10-13-55-16-19-62-32(2)51)30-59-26-36-23-49(46-43-36)11-14-56-17-20-63-33(3)52;1-4-12-24-16-21(17-25-13-5-2,18-26-14-6-3)22-20(23)15-27-19-10-8-7-9-11-19;1-12(16)21-11-10-20-9-8-19-7-6-18-5-4-17-3-2-14-15-13;14-7-12(8-15,9-16)13-11(17)6-18-10-4-2-1-3-5-10;1-12(14)19-11-10-18-9-8-17-7-6-16-5-4-15-3-2-13;9-8(10)6-11-7-4-2-1-3-5-7;12-7(10-3-1-8-5-10)11-4-2-9-6-11;5-4(1-6,2-7)3-8;1-2-3-4;2-1-4-3;;;;/h4-8,21-23H,9-20,24-30H2,1-3H3,(H,40,53);1-3,7-11H,12-18H2,(H,22,23);2-11H2,1H3;1-5,14-16H,6-9H2,(H,13,17);13H,2-11H2,1H3;1-5H,6H2;1-6H;6-8H,1-3,5H2;1H,3H2;1,3H;;;1H2;/q;;;;;;;;;;2*+1;;-1
InChIKeyDQCUKLJXGXETCA-UHFFFAOYSA-N
MW2911.69 g/mol
LogP-3.78
Rot. Bonds90

About dipotassium;S-[2-[2-[4-[[2-[[1-[2-(2-acetylsulfanylethoxy)ethyl]-2H-triazol-1-ium-4-yl]methoxymethyl]-3-[[1-[2-(2-acetylsulfanylethoxy)ethyl]triazol-4-yl]methoxy]-2-[(2-phenoxyacetyl)amino]propoxy]methyl]triazol-1-yl]ethoxy]ethyl] ethanethioate;2-amino-2-(hydroxymethyl)propane-1,3-diol;S-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;N-[1,3-bis(prop-2-ynoxy)-2-(prop-2-ynoxymethyl)propan-2-yl]-2-phenoxyacetamide;3-bromoprop-1-yne;N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-phenoxyacetamide;di(imidazol-1-yl)methanone;hydride;S-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;oxido formate;2-phenoxyacetyl chloride;hydrate

dipotassium;S-[2-[2-[4-[[2-[[1-[2-(2-acetylsulfanylethoxy)ethyl]-2H-triazol-1-ium-4-yl]methoxymethyl]-3-[[1-[2-(2-acetylsulfanylethoxy)ethyl]triazol-4-yl]methoxy]-2-[(2-phenoxyacetyl)amino]propoxy]methyl]triazol-1-yl]ethoxy]ethyl] ethanethioate;2-amino-2-(hydroxymethyl)propane-1,3-diol;S-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;N-[1,3-bis(prop-2-ynoxy)-2-(prop-2-ynoxymethyl)propan-2-yl]-2-phenoxyacetamide;3-bromoprop-1-yne;N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-phenoxyacetamide;di(imidazol-1-yl)methanone;hydride;S-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;oxido formate;2-phenoxyacetyl chloride;hydrate (PubChem CID 159464828) has the molecular formula C119H175BrClK2N20O42S5+ and a molecular weight of 2911.69 g/mol. Its IUPAC name is dipotassium;S-[2-[2-[4-[[2-[[1-[2-(2-acetylsulfanylethoxy)ethyl]-2H-triazol-1-ium-4-yl]methoxymethyl]-3-[[1-[2-(2-acetylsulfanylethoxy)ethyl]triazol-4-yl]methoxy]-2-[(2-phenoxyacetyl)amino]propoxy]methyl]triazol-1-yl]ethoxy]ethyl] ethanethioate;2-amino-2-(hydroxymethyl)propane-1,3-diol;S-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;N-[1,3-bis(prop-2-ynoxy)-2-(prop-2-ynoxymethyl)propan-2-yl]-2-phenoxyacetamide;3-bromoprop-1-yne;N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-phenoxyacetamide;di(imidazol-1-yl)methanone;hydride;S-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;oxido formate;2-phenoxyacetyl chloride;hydrate.

Molecular Properties

Compound Namedipotassium;S-[2-[2-[4-[[2-[[1-[2-(2-acetylsulfanylethoxy)ethyl]-2H-triazol-1-ium-4-yl]methoxymethyl]-3-[[1-[2-(2-acetylsulfanylethoxy)ethyl]triazol-4-yl]methoxy]-2-[(2-phenoxyacetyl)amino]propoxy]methyl]triazol-1-yl]ethoxy]ethyl] ethanethioate;2-amino-2-(hydroxymethyl)propane-1,3-diol;S-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;N-[1,3-bis(prop-2-ynoxy)-2-(prop-2-ynoxymethyl)propan-2-yl]-2-phenoxyacetamide;3-bromoprop-1-yne;N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-phenoxyacetamide;di(imidazol-1-yl)methanone;hydride;S-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;oxido formate;2-phenoxyacetyl chloride;hydrate
PubChem CID159464828
Molecular FormulaC119H175BrClK2N20O42S5+
Molecular Weight2911.69 g/mol
Exact Mass2907.89
IUPAC Namedipotassium;S-[2-[2-[4-[[2-[[1-[2-(2-acetylsulfanylethoxy)ethyl]-2H-triazol-1-ium-4-yl]methoxymethyl]-3-[[1-[2-(2-acetylsulfanylethoxy)ethyl]triazol-4-yl]methoxy]-2-[(2-phenoxyacetyl)amino]propoxy]methyl]triazol-1-yl]ethoxy]ethyl] ethanethioate;2-amino-2-(hydroxymethyl)propane-1,3-diol;S-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;N-[1,3-bis(prop-2-ynoxy)-2-(prop-2-ynoxymethyl)propan-2-yl]-2-phenoxyacetamide;3-bromoprop-1-yne;N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-phenoxyacetamide;di(imidazol-1-yl)methanone;hydride;S-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;oxido formate;2-phenoxyacetyl chloride;hydrate
SMILESC#CCBr.C#CCOCC(COCC#C)(COCC#C)NC(=O)COc1ccccc1.CC(=O)SCCOCCOCCOCCOCCN=[N+]=[N-].CC(=O)SCCOCCOCCOCCOCCO.CC(=O)SCCOCCn1cc(COCC(COCc2cn(CCOCCSC(C)=O)nn2)(COCc2c[n+](CCOCCSC(C)=O)[nH]n2)NC(=O)COc2ccccc2)nn1.NC(CO)(CO)CO.O.O=C(COc1ccccc1)NC(CO)(CO)CO.O=C(Cl)COc1ccccc1.O=C(n1ccnc1)n1ccnc1.O=CO[O-].[H-].[K+].[K+]
InChIInChI=1S/C39H56N10O11S3.C21H23NO5.C12H23N3O5S.C12H17NO5.C12H24O6S.C8H7ClO2.C7H6N4O.C4H11NO3.C3H3Br.CH2O3.2K.H2O.H/c1-31(50)61-18-15-54-12-9-47-21-34(41-44-47)24-57-28-39(40-38(53)27-60-37-7-5-4-6-8-37,29-58-25-35-22-48(45-42-35)10-13-55-16-19-62-32(2)51)30-59-26-36-23-49(46-43-36)11-14-56-17-20-63-33(3)52;1-4-12-24-16-21(17-25-13-5-2,18-26-14-6-3)22-20(23)15-27-19-10-8-7-9-11-19;1-12(16)21-11-10-20-9-8-19-7-6-18-5-4-17-3-2-14-15-13;14-7-12(8-15,9-16)13-11(17)6-18-10-4-2-1-3-5-10;1-12(14)19-11-10-18-9-8-17-7-6-16-5-4-15-3-2-13;9-8(10)6-11-7-4-2-1-3-5-7;12-7(10-3-1-8-5-10)11-4-2-9-6-11;5-4(1-6,2-7)3-8;1-2-3-4;2-1-4-3;;;;/h4-8,21-23H,9-20,24-30H2,1-3H3,(H,40,53);1-3,7-11H,12-18H2,(H,22,23);2-11H2,1H3;1-5,14-16H,6-9H2,(H,13,17);13H,2-11H2,1H3;1-5H,6H2;1-6H;6-8H,1-3,5H2;1H,3H2;1,3H;;;1H2;/q;;;;;;;;;;2*+1;;-1
InChIKeyDQCUKLJXGXETCA-UHFFFAOYSA-N
XLogP-3.78
TPSA827.49 Ų
H-Bond Donors12
H-Bond Acceptors59
Rotatable Bonds90
Heavy Atoms190
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002911.69
LogP ≤ 5-3.78
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1059

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'acid_halide', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Analyze dipotassium;S-[2-[2-[4-[[2-[[1-[2-(2-acetylsulfanylethoxy)ethyl]-2H-triazol-1-ium-4-yl]methoxymethyl]-3-[[1-[2-(2-acetylsulfanylethoxy)ethyl]triazol-4-yl]methoxy]-2-[(2-phenoxyacetyl)amino]propoxy]methyl]triazol-1-yl]ethoxy]ethyl] ethanethioate;2-amino-2-(hydroxymethyl)propane-1,3-diol;S-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;N-[1,3-bis(prop-2-ynoxy)-2-(prop-2-ynoxymethyl)propan-2-yl]-2-phenoxyacetamide;3-bromoprop-1-yne;N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-phenoxyacetamide;di(imidazol-1-yl)methanone;hydride;S-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;oxido formate;2-phenoxyacetyl chloride;hydrate with MolForge

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Frequently Asked Questions

What is the IUPAC name of dipotassium;S-[2-[2-[4-[[2-[[1-[2-(2-acetylsulfanylethoxy)ethyl]-2H-triazol-1-ium-4-yl]methoxymethyl]-3-[[1-[2-(2-acetylsulfanylethoxy)ethyl]triazol-4-yl]methoxy]-2-[(2-phenoxyacetyl)amino]propoxy]methyl]triazol-1-yl]ethoxy]ethyl] ethanethioate;2-amino-2-(hydroxymethyl)propane-1,3-diol;S-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;N-[1,3-bis(prop-2-ynoxy)-2-(prop-2-ynoxymethyl)propan-2-yl]-2-phenoxyacetamide;3-bromoprop-1-yne;N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-phenoxyacetamide;di(imidazol-1-yl)methanone;hydride;S-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;oxido formate;2-phenoxyacetyl chloride;hydrate?
The IUPAC name of dipotassium;S-[2-[2-[4-[[2-[[1-[2-(2-acetylsulfanylethoxy)ethyl]-2H-triazol-1-ium-4-yl]methoxymethyl]-3-[[1-[2-(2-acetylsulfanylethoxy)ethyl]triazol-4-yl]methoxy]-2-[(2-phenoxyacetyl)amino]propoxy]methyl]triazol-1-yl]ethoxy]ethyl] ethanethioate;2-amino-2-(hydroxymethyl)propane-1,3-diol;S-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;N-[1,3-bis(prop-2-ynoxy)-2-(prop-2-ynoxymethyl)propan-2-yl]-2-phenoxyacetamide;3-bromoprop-1-yne;N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-phenoxyacetamide;di(imidazol-1-yl)methanone;hydride;S-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;oxido formate;2-phenoxyacetyl chloride;hydrate (CID 159464828) is dipotassium;S-[2-[2-[4-[[2-[[1-[2-(2-acetylsulfanylethoxy)ethyl]-2H-triazol-1-ium-4-yl]methoxymethyl]-3-[[1-[2-(2-acetylsulfanylethoxy)ethyl]triazol-4-yl]methoxy]-2-[(2-phenoxyacetyl)amino]propoxy]methyl]triazol-1-yl]ethoxy]ethyl] ethanethioate;2-amino-2-(hydroxymethyl)propane-1,3-diol;S-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;N-[1,3-bis(prop-2-ynoxy)-2-(prop-2-ynoxymethyl)propan-2-yl]-2-phenoxyacetamide;3-bromoprop-1-yne;N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-phenoxyacetamide;di(imidazol-1-yl)methanone;hydride;S-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;oxido formate;2-phenoxyacetyl chloride;hydrate.
What is the SMILES notation for dipotassium;S-[2-[2-[4-[[2-[[1-[2-(2-acetylsulfanylethoxy)ethyl]-2H-triazol-1-ium-4-yl]methoxymethyl]-3-[[1-[2-(2-acetylsulfanylethoxy)ethyl]triazol-4-yl]methoxy]-2-[(2-phenoxyacetyl)amino]propoxy]methyl]triazol-1-yl]ethoxy]ethyl] ethanethioate;2-amino-2-(hydroxymethyl)propane-1,3-diol;S-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;N-[1,3-bis(prop-2-ynoxy)-2-(prop-2-ynoxymethyl)propan-2-yl]-2-phenoxyacetamide;3-bromoprop-1-yne;N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-phenoxyacetamide;di(imidazol-1-yl)methanone;hydride;S-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;oxido formate;2-phenoxyacetyl chloride;hydrate?
The canonical SMILES for dipotassium;S-[2-[2-[4-[[2-[[1-[2-(2-acetylsulfanylethoxy)ethyl]-2H-triazol-1-ium-4-yl]methoxymethyl]-3-[[1-[2-(2-acetylsulfanylethoxy)ethyl]triazol-4-yl]methoxy]-2-[(2-phenoxyacetyl)amino]propoxy]methyl]triazol-1-yl]ethoxy]ethyl] ethanethioate;2-amino-2-(hydroxymethyl)propane-1,3-diol;S-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;N-[1,3-bis(prop-2-ynoxy)-2-(prop-2-ynoxymethyl)propan-2-yl]-2-phenoxyacetamide;3-bromoprop-1-yne;N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-phenoxyacetamide;di(imidazol-1-yl)methanone;hydride;S-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;oxido formate;2-phenoxyacetyl chloride;hydrate is C#CCBr.C#CCOCC(COCC#C)(COCC#C)NC(=O)COc1ccccc1.CC(=O)SCCOCCOCCOCCOCCN=[N+]=[N-].CC(=O)SCCOCCOCCOCCOCCO.CC(=O)SCCOCCn1cc(COCC(COCc2cn(CCOCCSC(C)=O)nn2)(COCc2c[n+](CCOCCSC(C)=O)[nH]n2)NC(=O)COc2ccccc2)nn1.NC(CO)(CO)CO.O.O=C(COc1ccccc1)NC(CO)(CO)CO.O=C(Cl)COc1ccccc1.O=C(n1ccnc1)n1ccnc1.O=CO[O-].[H-].[K+].[K+].
What is the InChIKey of dipotassium;S-[2-[2-[4-[[2-[[1-[2-(2-acetylsulfanylethoxy)ethyl]-2H-triazol-1-ium-4-yl]methoxymethyl]-3-[[1-[2-(2-acetylsulfanylethoxy)ethyl]triazol-4-yl]methoxy]-2-[(2-phenoxyacetyl)amino]propoxy]methyl]triazol-1-yl]ethoxy]ethyl] ethanethioate;2-amino-2-(hydroxymethyl)propane-1,3-diol;S-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;N-[1,3-bis(prop-2-ynoxy)-2-(prop-2-ynoxymethyl)propan-2-yl]-2-phenoxyacetamide;3-bromoprop-1-yne;N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-phenoxyacetamide;di(imidazol-1-yl)methanone;hydride;S-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;oxido formate;2-phenoxyacetyl chloride;hydrate?
The InChIKey is DQCUKLJXGXETCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H56N10O11S3.C21H23NO5.C12H23N3O5S.C12H17NO5.C12H24O6S.C8H7ClO2.C7H6N4O.C4H11NO3.C3H3Br.CH2O3.2K.H2O.H/c1-31(50)61-18-15-54-12-9-47-21-34(41-44-47)24-57-28-39(40-38(53)27-60-37-7-5-4-6-8-37,29-58-25-35-22-48(45-42-35)10-13-55-16-19-62-32(2)51)30-59-26-36-23-49(46-43-36)11-14-56-17-20-63-33(3)52;1-4-12-24-16-21(17-25-13-5-2,18-26-14-6-3)22-20(23)15-27-19-10-8-7-9-11-19;1-12(16)21-11-10-20-9-8-19-7-6-18-5-4-17-3-2-14-15-13;14-7-12(8-15,9-16)13-11(17)6-18-10-4-2-1-3-5-10;1-12(14)19-11-10-18-9-8-17-7-6-16-5-4-15-3-2-13;9-8(10)6-11-7-4-2-1-3-5-7;12-7(10-3-1-8-5-10)11-4-2-9-6-11;5-4(1-6,2-7)3-8;1-2-3-4;2-1-4-3;;;;/h4-8,21-23H,9-20,24-30H2,1-3H3,(H,40,53);1-3,7-11H,12-18H2,(H,22,23);2-11H2,1H3;1-5,14-16H,6-9H2,(H,13,17);13H,2-11H2,1H3;1-5H,6H2;1-6H;6-8H,1-3,5H2;1H,3H2;1,3H;;;1H2;/q;;;;;;;;;;2*+1;;-1.
What are the key properties of dipotassium;S-[2-[2-[4-[[2-[[1-[2-(2-acetylsulfanylethoxy)ethyl]-2H-triazol-1-ium-4-yl]methoxymethyl]-3-[[1-[2-(2-acetylsulfanylethoxy)ethyl]triazol-4-yl]methoxy]-2-[(2-phenoxyacetyl)amino]propoxy]methyl]triazol-1-yl]ethoxy]ethyl] ethanethioate;2-amino-2-(hydroxymethyl)propane-1,3-diol;S-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;N-[1,3-bis(prop-2-ynoxy)-2-(prop-2-ynoxymethyl)propan-2-yl]-2-phenoxyacetamide;3-bromoprop-1-yne;N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-phenoxyacetamide;di(imidazol-1-yl)methanone;hydride;S-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;oxido formate;2-phenoxyacetyl chloride;hydrate?
dipotassium;S-[2-[2-[4-[[2-[[1-[2-(2-acetylsulfanylethoxy)ethyl]-2H-triazol-1-ium-4-yl]methoxymethyl]-3-[[1-[2-(2-acetylsulfanylethoxy)ethyl]triazol-4-yl]methoxy]-2-[(2-phenoxyacetyl)amino]propoxy]methyl]triazol-1-yl]ethoxy]ethyl] ethanethioate;2-amino-2-(hydroxymethyl)propane-1,3-diol;S-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;N-[1,3-bis(prop-2-ynoxy)-2-(prop-2-ynoxymethyl)propan-2-yl]-2-phenoxyacetamide;3-bromoprop-1-yne;N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-phenoxyacetamide;di(imidazol-1-yl)methanone;hydride;S-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;oxido formate;2-phenoxyacetyl chloride;hydrate has a molecular weight of 2911.69 g/mol, XLogP of -3.78, 90 rotatable bonds, 12 hydrogen bond donors, and 59 hydrogen bond acceptors.
Where does this data come from?
All data for dipotassium;S-[2-[2-[4-[[2-[[1-[2-(2-acetylsulfanylethoxy)ethyl]-2H-triazol-1-ium-4-yl]methoxymethyl]-3-[[1-[2-(2-acetylsulfanylethoxy)ethyl]triazol-4-yl]methoxy]-2-[(2-phenoxyacetyl)amino]propoxy]methyl]triazol-1-yl]ethoxy]ethyl] ethanethioate;2-amino-2-(hydroxymethyl)propane-1,3-diol;S-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;N-[1,3-bis(prop-2-ynoxy)-2-(prop-2-ynoxymethyl)propan-2-yl]-2-phenoxyacetamide;3-bromoprop-1-yne;N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-phenoxyacetamide;di(imidazol-1-yl)methanone;hydride;S-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethyl] ethanethioate;oxido formate;2-phenoxyacetyl chloride;hydrate is sourced from PubChem (CID 159464828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).