4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;2-[2-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[4-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-4-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[2-[(E)-1-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]prop-1-enyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]prop-1-en-2-yl]pyridin-1-ium-1-yl]ethanol;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline

C296H352N32O6S16+16 — CID 158761060

IUPAC4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;2-[2-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[4-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-4-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[2-[(E)-1-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]prop-1-enyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]prop-1-en-2-yl]pyridin-1-ium-1-yl]ethanol;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline
SMILESC/C(=C\c1ccc(N(C)CCSSCCN(C)c2ccc(/C=C(\C)c3cccc[n+]3CCO)cc2)cc1)c1cccc[n+]1CCO.CC[n+]1ccc(/C=C/c2ccc(N(C)CCSSCCN(C)c3ccc(/C=C/c4cc[n+](CC)cc4)cc3)cc2)cc1.CC[n+]1ccccc1/C=C/c1ccc(N(C)CCSSCCN(C)c2ccc(/C=C/c3cccc[n+]3CC)cc2)cc1.CN(CCSSCCN(C)c1ccc(/C=C/c2cc[n+](C)cc2)cc1)c1ccc(/C=C/c2cc[n+](C)cc2)cc1.CN(CCSSCCN(C)c1ccc(/C=C/c2cc[n+](CCO)cc2)cc1)c1ccc(/C=C/c2cc[n+](CCO)cc2)cc1.CN(CCSSCCN(C)c1ccc(/C=C/c2cc[n+](Cc3ccccc3)cc2)cc1)c1ccc(/C=C/c2cc[n+](Cc3ccccc3)cc2)cc1.CN(CCSSCCN(C)c1ccc(/C=C/c2cccc[n+]2C)cc1)c1ccc(/C=C/c2cccc[n+]2C)cc1.CN(CCSSCCN(C)c1ccc(/C=C/c2cccc[n+]2CCO)cc1)c1ccc(/C=C/c2cccc[n+]2CCO)cc1
InChIInChI=1S/C46H48N4S2.C38H48N4O2S2.2C36H44N4O2S2.2C36H44N4S2.2C34H40N4S2/c1-47(45-21-17-39(18-22-45)13-15-41-25-29-49(30-26-41)37-43-9-5-3-6-10-43)33-35-51-52-36-34-48(2)46-23-19-40(20-24-46)14-16-42-27-31-50(32-28-42)38-44-11-7-4-8-12-44;1-31(37-9-5-7-19-41(37)21-25-43)29-33-11-15-35(16-12-33)39(3)23-27-45-46-28-24-40(4)36-17-13-34(14-18-36)30-32(2)38-10-6-8-20-42(38)22-26-44;1-37(35-11-7-31(8-12-35)3-5-33-15-19-39(20-16-33)23-27-41)25-29-43-44-30-26-38(2)36-13-9-32(10-14-36)4-6-34-17-21-40(22-18-34)24-28-42;1-37(33-15-9-31(10-16-33)13-19-35-7-3-5-21-39(35)23-27-41)25-29-43-44-30-26-38(2)34-17-11-32(12-18-34)14-20-36-8-4-6-22-40(36)24-28-42;1-5-39-23-19-33(20-24-39)9-7-31-11-15-35(16-12-31)37(3)27-29-41-42-30-28-38(4)36-17-13-32(14-18-36)8-10-34-21-25-40(6-2)26-22-34;1-5-39-25-9-7-11-35(39)23-17-31-13-19-33(20-14-31)37(3)27-29-41-42-30-28-38(4)34-21-15-32(16-22-34)18-24-36-12-8-10-26-40(36)6-2;1-35-21-17-31(18-22-35)7-5-29-9-13-33(14-10-29)37(3)25-27-39-40-28-26-38(4)34-15-11-30(12-16-34)6-8-32-19-23-36(2)24-20-32;1-35-23-7-5-9-31(35)17-11-29-13-19-33(20-14-29)37(3)25-27-39-40-28-26-38(4)34-21-15-30(16-22-34)12-18-32-10-6-8-24-36(32)2/h3-32H,33-38H2,1-2H3;5-20,29-30,43-44H,21-28H2,1-4H3;2*3-22,41-42H,23-30H2,1-2H3;2*7-26H,5-6,27-30H2,1-4H3;2*5-24H,25-28H2,1-4H3/q8*+2
InChIKeyIORFDIQTUQHIMQ-UHFFFAOYSA-N
MW4967.36 g/mol
LogP55.51
Rot. Bonds124

About 4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;2-[2-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[4-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-4-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[2-[(E)-1-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]prop-1-enyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]prop-1-en-2-yl]pyridin-1-ium-1-yl]ethanol;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline

4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;2-[2-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[4-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-4-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[2-[(E)-1-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]prop-1-enyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]prop-1-en-2-yl]pyridin-1-ium-1-yl]ethanol;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline (PubChem CID 158761060) has the molecular formula C296H352N32O6S16+16 and a molecular weight of 4967.36 g/mol. Its IUPAC name is 4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;2-[2-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[4-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-4-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[2-[(E)-1-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]prop-1-enyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]prop-1-en-2-yl]pyridin-1-ium-1-yl]ethanol;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline.

Molecular Properties

Compound Name4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;2-[2-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[4-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-4-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[2-[(E)-1-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]prop-1-enyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]prop-1-en-2-yl]pyridin-1-ium-1-yl]ethanol;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline
PubChem CID158761060
Molecular FormulaC296H352N32O6S16+16
Molecular Weight4967.36 g/mol
Exact Mass4962.37
IUPAC Name4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;2-[2-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[4-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-4-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[2-[(E)-1-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]prop-1-enyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]prop-1-en-2-yl]pyridin-1-ium-1-yl]ethanol;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline
SMILESC/C(=C\c1ccc(N(C)CCSSCCN(C)c2ccc(/C=C(\C)c3cccc[n+]3CCO)cc2)cc1)c1cccc[n+]1CCO.CC[n+]1ccc(/C=C/c2ccc(N(C)CCSSCCN(C)c3ccc(/C=C/c4cc[n+](CC)cc4)cc3)cc2)cc1.CC[n+]1ccccc1/C=C/c1ccc(N(C)CCSSCCN(C)c2ccc(/C=C/c3cccc[n+]3CC)cc2)cc1.CN(CCSSCCN(C)c1ccc(/C=C/c2cc[n+](C)cc2)cc1)c1ccc(/C=C/c2cc[n+](C)cc2)cc1.CN(CCSSCCN(C)c1ccc(/C=C/c2cc[n+](CCO)cc2)cc1)c1ccc(/C=C/c2cc[n+](CCO)cc2)cc1.CN(CCSSCCN(C)c1ccc(/C=C/c2cc[n+](Cc3ccccc3)cc2)cc1)c1ccc(/C=C/c2cc[n+](Cc3ccccc3)cc2)cc1.CN(CCSSCCN(C)c1ccc(/C=C/c2cccc[n+]2C)cc1)c1ccc(/C=C/c2cccc[n+]2C)cc1.CN(CCSSCCN(C)c1ccc(/C=C/c2cccc[n+]2CCO)cc1)c1ccc(/C=C/c2cccc[n+]2CCO)cc1
InChIInChI=1S/C46H48N4S2.C38H48N4O2S2.2C36H44N4O2S2.2C36H44N4S2.2C34H40N4S2/c1-47(45-21-17-39(18-22-45)13-15-41-25-29-49(30-26-41)37-43-9-5-3-6-10-43)33-35-51-52-36-34-48(2)46-23-19-40(20-24-46)14-16-42-27-31-50(32-28-42)38-44-11-7-4-8-12-44;1-31(37-9-5-7-19-41(37)21-25-43)29-33-11-15-35(16-12-33)39(3)23-27-45-46-28-24-40(4)36-17-13-34(14-18-36)30-32(2)38-10-6-8-20-42(38)22-26-44;1-37(35-11-7-31(8-12-35)3-5-33-15-19-39(20-16-33)23-27-41)25-29-43-44-30-26-38(2)36-13-9-32(10-14-36)4-6-34-17-21-40(22-18-34)24-28-42;1-37(33-15-9-31(10-16-33)13-19-35-7-3-5-21-39(35)23-27-41)25-29-43-44-30-26-38(2)34-17-11-32(12-18-34)14-20-36-8-4-6-22-40(36)24-28-42;1-5-39-23-19-33(20-24-39)9-7-31-11-15-35(16-12-31)37(3)27-29-41-42-30-28-38(4)36-17-13-32(14-18-36)8-10-34-21-25-40(6-2)26-22-34;1-5-39-25-9-7-11-35(39)23-17-31-13-19-33(20-14-31)37(3)27-29-41-42-30-28-38(4)34-21-15-32(16-22-34)18-24-36-12-8-10-26-40(36)6-2;1-35-21-17-31(18-22-35)7-5-29-9-13-33(14-10-29)37(3)25-27-39-40-28-26-38(4)34-15-11-30(12-16-34)6-8-32-19-23-36(2)24-20-32;1-35-23-7-5-9-31(35)17-11-29-13-19-33(20-14-29)37(3)25-27-39-40-28-26-38(4)34-21-15-30(16-22-34)12-18-32-10-6-8-24-36(32)2/h3-32H,33-38H2,1-2H3;5-20,29-30,43-44H,21-28H2,1-4H3;2*3-22,41-42H,23-30H2,1-2H3;2*7-26H,5-6,27-30H2,1-4H3;2*5-24H,25-28H2,1-4H3/q8*+2
InChIKeyIORFDIQTUQHIMQ-UHFFFAOYSA-N
XLogP55.51
TPSA235.30 Ų
H-Bond Donors6
H-Bond Acceptors38
Rotatable Bonds124
Heavy Atoms350
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004967.36
LogP ≤ 555.51
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1038

Analyze 4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;2-[2-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[4-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-4-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[2-[(E)-1-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]prop-1-enyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]prop-1-en-2-yl]pyridin-1-ium-1-yl]ethanol;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;2-[2-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[4-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-4-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[2-[(E)-1-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]prop-1-enyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]prop-1-en-2-yl]pyridin-1-ium-1-yl]ethanol;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline?
The IUPAC name of 4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;2-[2-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[4-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-4-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[2-[(E)-1-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]prop-1-enyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]prop-1-en-2-yl]pyridin-1-ium-1-yl]ethanol;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline (CID 158761060) is 4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;2-[2-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[4-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-4-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[2-[(E)-1-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]prop-1-enyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]prop-1-en-2-yl]pyridin-1-ium-1-yl]ethanol;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline.
What is the SMILES notation for 4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;2-[2-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[4-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-4-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[2-[(E)-1-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]prop-1-enyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]prop-1-en-2-yl]pyridin-1-ium-1-yl]ethanol;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline?
The canonical SMILES for 4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;2-[2-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[4-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-4-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[2-[(E)-1-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]prop-1-enyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]prop-1-en-2-yl]pyridin-1-ium-1-yl]ethanol;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline is C/C(=C\c1ccc(N(C)CCSSCCN(C)c2ccc(/C=C(\C)c3cccc[n+]3CCO)cc2)cc1)c1cccc[n+]1CCO.CC[n+]1ccc(/C=C/c2ccc(N(C)CCSSCCN(C)c3ccc(/C=C/c4cc[n+](CC)cc4)cc3)cc2)cc1.CC[n+]1ccccc1/C=C/c1ccc(N(C)CCSSCCN(C)c2ccc(/C=C/c3cccc[n+]3CC)cc2)cc1.CN(CCSSCCN(C)c1ccc(/C=C/c2cc[n+](C)cc2)cc1)c1ccc(/C=C/c2cc[n+](C)cc2)cc1.CN(CCSSCCN(C)c1ccc(/C=C/c2cc[n+](CCO)cc2)cc1)c1ccc(/C=C/c2cc[n+](CCO)cc2)cc1.CN(CCSSCCN(C)c1ccc(/C=C/c2cc[n+](Cc3ccccc3)cc2)cc1)c1ccc(/C=C/c2cc[n+](Cc3ccccc3)cc2)cc1.CN(CCSSCCN(C)c1ccc(/C=C/c2cccc[n+]2C)cc1)c1ccc(/C=C/c2cccc[n+]2C)cc1.CN(CCSSCCN(C)c1ccc(/C=C/c2cccc[n+]2CCO)cc1)c1ccc(/C=C/c2cccc[n+]2CCO)cc1.
What is the InChIKey of 4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;2-[2-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[4-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-4-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[2-[(E)-1-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]prop-1-enyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]prop-1-en-2-yl]pyridin-1-ium-1-yl]ethanol;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline?
The InChIKey is IORFDIQTUQHIMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H48N4S2.C38H48N4O2S2.2C36H44N4O2S2.2C36H44N4S2.2C34H40N4S2/c1-47(45-21-17-39(18-22-45)13-15-41-25-29-49(30-26-41)37-43-9-5-3-6-10-43)33-35-51-52-36-34-48(2)46-23-19-40(20-24-46)14-16-42-27-31-50(32-28-42)38-44-11-7-4-8-12-44;1-31(37-9-5-7-19-41(37)21-25-43)29-33-11-15-35(16-12-33)39(3)23-27-45-46-28-24-40(4)36-17-13-34(14-18-36)30-32(2)38-10-6-8-20-42(38)22-26-44;1-37(35-11-7-31(8-12-35)3-5-33-15-19-39(20-16-33)23-27-41)25-29-43-44-30-26-38(2)36-13-9-32(10-14-36)4-6-34-17-21-40(22-18-34)24-28-42;1-37(33-15-9-31(10-16-33)13-19-35-7-3-5-21-39(35)23-27-41)25-29-43-44-30-26-38(2)34-17-11-32(12-18-34)14-20-36-8-4-6-22-40(36)24-28-42;1-5-39-23-19-33(20-24-39)9-7-31-11-15-35(16-12-31)37(3)27-29-41-42-30-28-38(4)36-17-13-32(14-18-36)8-10-34-21-25-40(6-2)26-22-34;1-5-39-25-9-7-11-35(39)23-17-31-13-19-33(20-14-31)37(3)27-29-41-42-30-28-38(4)34-21-15-32(16-22-34)18-24-36-12-8-10-26-40(36)6-2;1-35-21-17-31(18-22-35)7-5-29-9-13-33(14-10-29)37(3)25-27-39-40-28-26-38(4)34-15-11-30(12-16-34)6-8-32-19-23-36(2)24-20-32;1-35-23-7-5-9-31(35)17-11-29-13-19-33(20-14-29)37(3)25-27-39-40-28-26-38(4)34-21-15-30(16-22-34)12-18-32-10-6-8-24-36(32)2/h3-32H,33-38H2,1-2H3;5-20,29-30,43-44H,21-28H2,1-4H3;2*3-22,41-42H,23-30H2,1-2H3;2*7-26H,5-6,27-30H2,1-4H3;2*5-24H,25-28H2,1-4H3/q8*+2.
What are the key properties of 4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;2-[2-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[4-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-4-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[2-[(E)-1-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]prop-1-enyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]prop-1-en-2-yl]pyridin-1-ium-1-yl]ethanol;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline?
4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;2-[2-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[4-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-4-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[2-[(E)-1-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]prop-1-enyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]prop-1-en-2-yl]pyridin-1-ium-1-yl]ethanol;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline has a molecular weight of 4967.36 g/mol, XLogP of 55.51, 124 rotatable bonds, 6 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-benzylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-2-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-[2-[2-[4-[(E)-2-(1-ethylpyridin-1-ium-4-yl)ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl]-N-methylaniline;2-[2-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[4-[(E)-2-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-4-yl]ethenyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]ethenyl]pyridin-1-ium-1-yl]ethanol;2-[2-[(E)-1-[4-[2-[2-[4-[(E)-2-[1-(2-hydroxyethyl)pyridin-1-ium-2-yl]prop-1-enyl]-N-methylanilino]ethyldisulfanyl]ethyl-methylamino]phenyl]prop-1-en-2-yl]pyridin-1-ium-1-yl]ethanol;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline;N-methyl-N-[2-[2-[N-methyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]anilino]ethyldisulfanyl]ethyl]-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]aniline is sourced from PubChem (CID 158761060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).