1-(3,4-dimethylphenyl)-2-[2-hydroxy-2-[4-methyl-3-(trifluoromethyl)phenyl]ethyl]sulfanylethanol;4-[1-hydroxy-2-[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]sulfanylethyl]-2-methylphenol;2-[2-hydroxy-2-[3-(hydroxymethyl)-2-methoxyphenyl]ethyl]sulfanyl-1-(2-methoxy-3-methylphenyl)ethanol;bis(2-[2-hydroxy-2-(4-methylphenyl)ethyl]sulfanyl-1-(4-methylphenyl)ethanol);2-[2-hydroxy-2-[3-methyl-5-(trifluoromethyl)phenyl]ethyl]sulfanyl-1-[3-methyl-5-(trifluoromethyl)phenyl]ethanol;2-(2-hydroxy-2-phenylethyl)sulfanyl-1-phenylethanol

C130H153F9O20S7 — CID 160698672

IUPAC1-(3,4-dimethylphenyl)-2-[2-hydroxy-2-[4-methyl-3-(trifluoromethyl)phenyl]ethyl]sulfanylethanol;4-[1-hydroxy-2-[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]sulfanylethyl]-2-methylphenol;2-[2-hydroxy-2-[3-(hydroxymethyl)-2-methoxyphenyl]ethyl]sulfanyl-1-(2-methoxy-3-methylphenyl)ethanol;bis(2-[2-hydroxy-2-(4-methylphenyl)ethyl]sulfanyl-1-(4-methylphenyl)ethanol);2-[2-hydroxy-2-[3-methyl-5-(trifluoromethyl)phenyl]ethyl]sulfanyl-1-[3-methyl-5-(trifluoromethyl)phenyl]ethanol;2-(2-hydroxy-2-phenylethyl)sulfanyl-1-phenylethanol
SMILESCOc1c(C)cccc1C(O)CSCC(O)c1cccc(CO)c1OC.Cc1cc(C(O)CSCC(O)c2cc(C)cc(C(F)(F)F)c2)cc(C(F)(F)F)c1.Cc1cc(C(O)CSCC(O)c2ccc(O)c(CO)c2)ccc1O.Cc1ccc(C(O)CSCC(O)c2ccc(C)c(C(F)(F)F)c2)cc1C.Cc1ccc(C(O)CSCC(O)c2ccc(C)cc2)cc1.Cc1ccc(C(O)CSCC(O)c2ccc(C)cc2)cc1.OC(CSCC(O)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H20F6O2S.C20H23F3O2S.C20H26O5S.C18H22O5S.2C18H22O2S.C16H18O2S/c1-11-3-13(7-15(5-11)19(21,22)23)17(27)9-29-10-18(28)14-4-12(2)6-16(8-14)20(24,25)26;1-12-4-6-15(8-14(12)3)18(24)10-26-11-19(25)16-7-5-13(2)17(9-16)20(21,22)23;1-13-6-4-8-15(19(13)24-2)17(22)11-26-12-18(23)16-9-5-7-14(10-21)20(16)25-3;1-11-6-12(2-4-15(11)20)17(22)9-24-10-18(23)13-3-5-16(21)14(7-13)8-19;2*1-13-3-7-15(8-4-13)17(19)11-21-12-18(20)16-9-5-14(2)6-10-16;17-15(13-7-3-1-4-8-13)11-19-12-16(18)14-9-5-2-6-10-14/h3-8,17-18,27-28H,9-10H2,1-2H3;4-9,18-19,24-25H,10-11H2,1-3H3;4-9,17-18,21-23H,10-12H2,1-3H3;2-7,17-23H,8-10H2,1H3;2*3-10,17-20H,11-12H2,1-2H3;1-10,15-18H,11-12H2
InChIKeyRQIBSKZJHSGPSM-UHFFFAOYSA-N
MW2431.08 g/mol
LogP27.17
Rot. Bonds46

About 1-(3,4-dimethylphenyl)-2-[2-hydroxy-2-[4-methyl-3-(trifluoromethyl)phenyl]ethyl]sulfanylethanol;4-[1-hydroxy-2-[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]sulfanylethyl]-2-methylphenol;2-[2-hydroxy-2-[3-(hydroxymethyl)-2-methoxyphenyl]ethyl]sulfanyl-1-(2-methoxy-3-methylphenyl)ethanol;bis(2-[2-hydroxy-2-(4-methylphenyl)ethyl]sulfanyl-1-(4-methylphenyl)ethanol);2-[2-hydroxy-2-[3-methyl-5-(trifluoromethyl)phenyl]ethyl]sulfanyl-1-[3-methyl-5-(trifluoromethyl)phenyl]ethanol;2-(2-hydroxy-2-phenylethyl)sulfanyl-1-phenylethanol

1-(3,4-dimethylphenyl)-2-[2-hydroxy-2-[4-methyl-3-(trifluoromethyl)phenyl]ethyl]sulfanylethanol;4-[1-hydroxy-2-[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]sulfanylethyl]-2-methylphenol;2-[2-hydroxy-2-[3-(hydroxymethyl)-2-methoxyphenyl]ethyl]sulfanyl-1-(2-methoxy-3-methylphenyl)ethanol;bis(2-[2-hydroxy-2-(4-methylphenyl)ethyl]sulfanyl-1-(4-methylphenyl)ethanol);2-[2-hydroxy-2-[3-methyl-5-(trifluoromethyl)phenyl]ethyl]sulfanyl-1-[3-methyl-5-(trifluoromethyl)phenyl]ethanol;2-(2-hydroxy-2-phenylethyl)sulfanyl-1-phenylethanol (PubChem CID 160698672) has the molecular formula C130H153F9O20S7 and a molecular weight of 2431.08 g/mol. Its IUPAC name is 1-(3,4-dimethylphenyl)-2-[2-hydroxy-2-[4-methyl-3-(trifluoromethyl)phenyl]ethyl]sulfanylethanol;4-[1-hydroxy-2-[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]sulfanylethyl]-2-methylphenol;2-[2-hydroxy-2-[3-(hydroxymethyl)-2-methoxyphenyl]ethyl]sulfanyl-1-(2-methoxy-3-methylphenyl)ethanol;bis(2-[2-hydroxy-2-(4-methylphenyl)ethyl]sulfanyl-1-(4-methylphenyl)ethanol);2-[2-hydroxy-2-[3-methyl-5-(trifluoromethyl)phenyl]ethyl]sulfanyl-1-[3-methyl-5-(trifluoromethyl)phenyl]ethanol;2-(2-hydroxy-2-phenylethyl)sulfanyl-1-phenylethanol.

Molecular Properties

Compound Name1-(3,4-dimethylphenyl)-2-[2-hydroxy-2-[4-methyl-3-(trifluoromethyl)phenyl]ethyl]sulfanylethanol;4-[1-hydroxy-2-[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]sulfanylethyl]-2-methylphenol;2-[2-hydroxy-2-[3-(hydroxymethyl)-2-methoxyphenyl]ethyl]sulfanyl-1-(2-methoxy-3-methylphenyl)ethanol;bis(2-[2-hydroxy-2-(4-methylphenyl)ethyl]sulfanyl-1-(4-methylphenyl)ethanol);2-[2-hydroxy-2-[3-methyl-5-(trifluoromethyl)phenyl]ethyl]sulfanyl-1-[3-methyl-5-(trifluoromethyl)phenyl]ethanol;2-(2-hydroxy-2-phenylethyl)sulfanyl-1-phenylethanol
PubChem CID160698672
Molecular FormulaC130H153F9O20S7
Molecular Weight2431.08 g/mol
Exact Mass2428.89
IUPAC Name1-(3,4-dimethylphenyl)-2-[2-hydroxy-2-[4-methyl-3-(trifluoromethyl)phenyl]ethyl]sulfanylethanol;4-[1-hydroxy-2-[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]sulfanylethyl]-2-methylphenol;2-[2-hydroxy-2-[3-(hydroxymethyl)-2-methoxyphenyl]ethyl]sulfanyl-1-(2-methoxy-3-methylphenyl)ethanol;bis(2-[2-hydroxy-2-(4-methylphenyl)ethyl]sulfanyl-1-(4-methylphenyl)ethanol);2-[2-hydroxy-2-[3-methyl-5-(trifluoromethyl)phenyl]ethyl]sulfanyl-1-[3-methyl-5-(trifluoromethyl)phenyl]ethanol;2-(2-hydroxy-2-phenylethyl)sulfanyl-1-phenylethanol
SMILESCOc1c(C)cccc1C(O)CSCC(O)c1cccc(CO)c1OC.Cc1cc(C(O)CSCC(O)c2cc(C)cc(C(F)(F)F)c2)cc(C(F)(F)F)c1.Cc1cc(C(O)CSCC(O)c2ccc(O)c(CO)c2)ccc1O.Cc1ccc(C(O)CSCC(O)c2ccc(C)c(C(F)(F)F)c2)cc1C.Cc1ccc(C(O)CSCC(O)c2ccc(C)cc2)cc1.Cc1ccc(C(O)CSCC(O)c2ccc(C)cc2)cc1.OC(CSCC(O)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H20F6O2S.C20H23F3O2S.C20H26O5S.C18H22O5S.2C18H22O2S.C16H18O2S/c1-11-3-13(7-15(5-11)19(21,22)23)17(27)9-29-10-18(28)14-4-12(2)6-16(8-14)20(24,25)26;1-12-4-6-15(8-14(12)3)18(24)10-26-11-19(25)16-7-5-13(2)17(9-16)20(21,22)23;1-13-6-4-8-15(19(13)24-2)17(22)11-26-12-18(23)16-9-5-7-14(10-21)20(16)25-3;1-11-6-12(2-4-15(11)20)17(22)9-24-10-18(23)13-3-5-16(21)14(7-13)8-19;2*1-13-3-7-15(8-4-13)17(19)11-21-12-18(20)16-9-5-14(2)6-10-16;17-15(13-7-3-1-4-8-13)11-19-12-16(18)14-9-5-2-6-10-14/h3-8,17-18,27-28H,9-10H2,1-2H3;4-9,18-19,24-25H,10-11H2,1-3H3;4-9,17-18,21-23H,10-12H2,1-3H3;2-7,17-23H,8-10H2,1H3;2*3-10,17-20H,11-12H2,1-2H3;1-10,15-18H,11-12H2
InChIKeyRQIBSKZJHSGPSM-UHFFFAOYSA-N
XLogP27.17
TPSA382.60 Ų
H-Bond Donors18
H-Bond Acceptors27
Rotatable Bonds46
Heavy Atoms166
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002431.08
LogP ≤ 527.17
H-Bond Donors ≤ 518
H-Bond Acceptors ≤ 1027

Analyze 1-(3,4-dimethylphenyl)-2-[2-hydroxy-2-[4-methyl-3-(trifluoromethyl)phenyl]ethyl]sulfanylethanol;4-[1-hydroxy-2-[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]sulfanylethyl]-2-methylphenol;2-[2-hydroxy-2-[3-(hydroxymethyl)-2-methoxyphenyl]ethyl]sulfanyl-1-(2-methoxy-3-methylphenyl)ethanol;bis(2-[2-hydroxy-2-(4-methylphenyl)ethyl]sulfanyl-1-(4-methylphenyl)ethanol);2-[2-hydroxy-2-[3-methyl-5-(trifluoromethyl)phenyl]ethyl]sulfanyl-1-[3-methyl-5-(trifluoromethyl)phenyl]ethanol;2-(2-hydroxy-2-phenylethyl)sulfanyl-1-phenylethanol with MolForge

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Related Compounds

(3R,4S,5S,6R)-2-[5-[(4-ethoxyphenyl)methyl]-2-methoxy-4-methylphenyl]-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)thian-2-ol
CID 11988951
6-(4-Methoxy-phenyl)-5-{4-[4-(4,4,5,5,5-pentafluoro-pentylsulfanyl)-butoxy]-phenoxy}-naphthalen-2-ol
CID 11157748
(3S,4S)-3-[4-(hydroxymethyl)phenyl]-3-methyl-4-[9-(4,4,5,5,5-pentafluoropentylsulfanyl)nonyl]-2,4-dihydrochromen-7-ol;(3S,4S)-3-methyl-3-(4-methylphenyl)-4-[9-(4,4,5,5,5-pentafluoropentylsulfanyl)nonyl]-2,4-dihydrochromen-7-ol
CID 90989854
6-(4-Methoxyphenyl)-5-[4-[4-(1,1,2,2,3-pentafluoropentylsulfanyl)butoxy]phenoxy]naphthalen-2-ol
CID 145724938
1-Ethoxy-4-propan-2-ylbenzene;methane;pentakis(1-methyl-3-propan-2-ylbenzene);tetrakis(1-methyl-4-propan-2-ylbenzene);1-phenoxy-4-propan-2-ylbenzene;2-propan-2-ylphenol;1-(4-propan-2-ylphenyl)ethanol;(2-propan-2-ylphenyl)methanol;(4-propan-2-ylphenyl)methanol;2-(4-propan-2-ylphenyl)propan-2-ol;bis(1-propan-2-yl-4-prop-1-enylbenzene);1-propan-2-yl-4-(trifluoromethoxy)benzene;1-propan-2-yl-4-(trifluoromethyl)benzene
CID 157497523
4-[(4-Butoxyphenyl)-difluoromethoxy]-2-tert-butyl-6-propan-2-ylphenol;2,6-ditert-butyl-4-[difluoro-(6-heptylthian-3-yl)methoxy]phenol;2,6-ditert-butyl-4-[difluoro-(5-pentyloxan-2-yl)methoxy]phenol;2,6-ditert-butyl-4-[difluoro-(4-pentylphenyl)methoxy]phenol;4-[difluoro-(4-heptylphenyl)methoxy]-2,6-dimethylphenol;4-[difluoro-(4-pentylphenyl)methoxy]-2,6-di(propan-2-yl)phenol;4-[difluoro-(4-propylphenyl)methoxy]-2,6-diethylphenol
CID 157789882
(3S,4S)-3-[4-(hydroxymethyl)phenyl]-3-methyl-4-[9-(4,4,5,5,5-pentafluoropentylsulfanyl)nonyl]-2,4-dihydrochromen-7-ol
CID 157804671
2-(4-Butan-2-yl-3,5-dimethylphenyl)-1,1,1-trifluoropropan-2-ol;2-(4-butan-2-yl-2-methoxyphenyl)-1,1,1-trifluoropropan-2-ol;2-(3-butan-2-ylphenyl)-1,1,1-trifluoropropan-2-ol;2-(4-butan-2-ylphenyl)-1,1,1-trifluoropropan-2-ol;5-butan-2-yl-2-(1,1,1-trifluoro-2-hydroxypropan-2-yl)phenol;2-[3-butan-2-yl-5-(1,1,1-trifluoro-2-hydroxypropan-2-yl)phenyl]-1,1,1-trifluoropropan-2-ol
CID 158096432
1-(3,4-Dimethylphenyl)-2-[2-hydroxy-2-[3-methyl-4-(trifluoromethyl)phenyl]ethyl]sulfanylethanol;4-[1-hydroxy-2-[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]sulfanylethyl]-2-methylphenol;2-[2-hydroxy-2-[3-(hydroxymethyl)-2-methoxyphenyl]ethyl]sulfanyl-1-(2-methoxy-3-methylphenyl)ethanol;bis(2-[2-hydroxy-2-(4-methylphenyl)ethyl]sulfanyl-1-(4-methylphenyl)ethanol);2-[2-hydroxy-2-[3-methyl-5-(trifluoromethyl)phenyl]ethyl]sulfanyl-1-[3-methyl-5-(trifluoromethyl)phenyl]ethanol;2-(2-hydroxy-2-phenylethyl)sulfanyl-1-phenylethanol;methane
CID 158224110
2-[3-[1-[3,5-Bis(2-hydroxypropan-2-yl)phenyl]cyclohexyl]-5-(2-hydroxypropan-2-yl)phenyl]propan-2-ol;2-[5-[1,1,1,3,3,3-hexafluoro-2-[3-(2-hydroxypropan-2-yl)-4-methoxyphenyl]propan-2-yl]-2-(hydroxymethyl)phenyl]propan-2-ol;4-[1-[4-hydroxy-3,5-bis(2-hydroxypropan-2-yl)phenyl]cyclohexyl]-2,6-bis(2-hydroxypropan-2-yl)phenol;4-[2-[4-hydroxy-3,5-bis(2-hydroxypropan-2-yl)phenyl]propan-2-yl]-2,6-bis(2-hydroxypropan-2-yl)phenol;2-[2-(hydroxymethyl)-5-[[3-(2-hydroxypropan-2-yl)-4-methoxyphenyl]methyl]phenyl]propan-2-ol;2-[2-(hydroxymethyl)-5-[2-[3-(2-hydroxypropan-2-yl)-4-methoxyphenyl]propan-2-yl]phenyl]propan-2-ol
CID 158454337
1-Propan-2-yl-3-(trifluoromethoxy)benzene;1-propan-2-yl-4-(trifluoromethoxy)benzene;2-propan-2-yl-4-(trifluoromethoxy)phenol;[2-propan-2-yl-4-(trifluoromethoxy)phenyl]methanol;2-propan-2-yl-4-(trifluoromethyl)phenol;[2-propan-2-yl-4-(trifluoromethyl)phenyl]methanol
CID 158506806
1-But-2-ynoxy-4-propan-2-ylbenzene;1-ethoxy-2-propan-2-ylbenzene;1-ethoxy-3-propan-2-ylbenzene;1-ethoxy-4-propan-2-ylbenzene;1-methoxy-2-propan-2-ylbenzene;bis(1-methyl-3-propan-2-ylbenzene);bis(1-methyl-4-propan-2-ylbenzene);1-methylsulfanyl-2-propan-2-ylbenzene;2-propan-2-ylphenol;3-propan-2-ylphenol;4-propan-2-ylphenol;(3-propan-2-ylphenyl)methanethiol;(4-propan-2-ylphenyl)methanethiol;(3-propan-2-ylphenyl)methanol;(4-propan-2-ylphenyl)methanol;1-propan-2-yl-4-propan-2-yloxybenzene;1-propan-2-yl-4-propoxybenzene;1-propan-2-yl-2-(trifluoromethoxy)benzene;1-propan-2-yl-2-(trifluoromethylsulfanyl)benzene
CID 158829511

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dimethylphenyl)-2-[2-hydroxy-2-[4-methyl-3-(trifluoromethyl)phenyl]ethyl]sulfanylethanol;4-[1-hydroxy-2-[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]sulfanylethyl]-2-methylphenol;2-[2-hydroxy-2-[3-(hydroxymethyl)-2-methoxyphenyl]ethyl]sulfanyl-1-(2-methoxy-3-methylphenyl)ethanol;bis(2-[2-hydroxy-2-(4-methylphenyl)ethyl]sulfanyl-1-(4-methylphenyl)ethanol);2-[2-hydroxy-2-[3-methyl-5-(trifluoromethyl)phenyl]ethyl]sulfanyl-1-[3-methyl-5-(trifluoromethyl)phenyl]ethanol;2-(2-hydroxy-2-phenylethyl)sulfanyl-1-phenylethanol?
The IUPAC name of 1-(3,4-dimethylphenyl)-2-[2-hydroxy-2-[4-methyl-3-(trifluoromethyl)phenyl]ethyl]sulfanylethanol;4-[1-hydroxy-2-[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]sulfanylethyl]-2-methylphenol;2-[2-hydroxy-2-[3-(hydroxymethyl)-2-methoxyphenyl]ethyl]sulfanyl-1-(2-methoxy-3-methylphenyl)ethanol;bis(2-[2-hydroxy-2-(4-methylphenyl)ethyl]sulfanyl-1-(4-methylphenyl)ethanol);2-[2-hydroxy-2-[3-methyl-5-(trifluoromethyl)phenyl]ethyl]sulfanyl-1-[3-methyl-5-(trifluoromethyl)phenyl]ethanol;2-(2-hydroxy-2-phenylethyl)sulfanyl-1-phenylethanol (CID 160698672) is 1-(3,4-dimethylphenyl)-2-[2-hydroxy-2-[4-methyl-3-(trifluoromethyl)phenyl]ethyl]sulfanylethanol;4-[1-hydroxy-2-[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]sulfanylethyl]-2-methylphenol;2-[2-hydroxy-2-[3-(hydroxymethyl)-2-methoxyphenyl]ethyl]sulfanyl-1-(2-methoxy-3-methylphenyl)ethanol;bis(2-[2-hydroxy-2-(4-methylphenyl)ethyl]sulfanyl-1-(4-methylphenyl)ethanol);2-[2-hydroxy-2-[3-methyl-5-(trifluoromethyl)phenyl]ethyl]sulfanyl-1-[3-methyl-5-(trifluoromethyl)phenyl]ethanol;2-(2-hydroxy-2-phenylethyl)sulfanyl-1-phenylethanol.
What is the SMILES notation for 1-(3,4-dimethylphenyl)-2-[2-hydroxy-2-[4-methyl-3-(trifluoromethyl)phenyl]ethyl]sulfanylethanol;4-[1-hydroxy-2-[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]sulfanylethyl]-2-methylphenol;2-[2-hydroxy-2-[3-(hydroxymethyl)-2-methoxyphenyl]ethyl]sulfanyl-1-(2-methoxy-3-methylphenyl)ethanol;bis(2-[2-hydroxy-2-(4-methylphenyl)ethyl]sulfanyl-1-(4-methylphenyl)ethanol);2-[2-hydroxy-2-[3-methyl-5-(trifluoromethyl)phenyl]ethyl]sulfanyl-1-[3-methyl-5-(trifluoromethyl)phenyl]ethanol;2-(2-hydroxy-2-phenylethyl)sulfanyl-1-phenylethanol?
The canonical SMILES for 1-(3,4-dimethylphenyl)-2-[2-hydroxy-2-[4-methyl-3-(trifluoromethyl)phenyl]ethyl]sulfanylethanol;4-[1-hydroxy-2-[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]sulfanylethyl]-2-methylphenol;2-[2-hydroxy-2-[3-(hydroxymethyl)-2-methoxyphenyl]ethyl]sulfanyl-1-(2-methoxy-3-methylphenyl)ethanol;bis(2-[2-hydroxy-2-(4-methylphenyl)ethyl]sulfanyl-1-(4-methylphenyl)ethanol);2-[2-hydroxy-2-[3-methyl-5-(trifluoromethyl)phenyl]ethyl]sulfanyl-1-[3-methyl-5-(trifluoromethyl)phenyl]ethanol;2-(2-hydroxy-2-phenylethyl)sulfanyl-1-phenylethanol is COc1c(C)cccc1C(O)CSCC(O)c1cccc(CO)c1OC.Cc1cc(C(O)CSCC(O)c2cc(C)cc(C(F)(F)F)c2)cc(C(F)(F)F)c1.Cc1cc(C(O)CSCC(O)c2ccc(O)c(CO)c2)ccc1O.Cc1ccc(C(O)CSCC(O)c2ccc(C)c(C(F)(F)F)c2)cc1C.Cc1ccc(C(O)CSCC(O)c2ccc(C)cc2)cc1.Cc1ccc(C(O)CSCC(O)c2ccc(C)cc2)cc1.OC(CSCC(O)c1ccccc1)c1ccccc1.
What is the InChIKey of 1-(3,4-dimethylphenyl)-2-[2-hydroxy-2-[4-methyl-3-(trifluoromethyl)phenyl]ethyl]sulfanylethanol;4-[1-hydroxy-2-[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]sulfanylethyl]-2-methylphenol;2-[2-hydroxy-2-[3-(hydroxymethyl)-2-methoxyphenyl]ethyl]sulfanyl-1-(2-methoxy-3-methylphenyl)ethanol;bis(2-[2-hydroxy-2-(4-methylphenyl)ethyl]sulfanyl-1-(4-methylphenyl)ethanol);2-[2-hydroxy-2-[3-methyl-5-(trifluoromethyl)phenyl]ethyl]sulfanyl-1-[3-methyl-5-(trifluoromethyl)phenyl]ethanol;2-(2-hydroxy-2-phenylethyl)sulfanyl-1-phenylethanol?
The InChIKey is RQIBSKZJHSGPSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20F6O2S.C20H23F3O2S.C20H26O5S.C18H22O5S.2C18H22O2S.C16H18O2S/c1-11-3-13(7-15(5-11)19(21,22)23)17(27)9-29-10-18(28)14-4-12(2)6-16(8-14)20(24,25)26;1-12-4-6-15(8-14(12)3)18(24)10-26-11-19(25)16-7-5-13(2)17(9-16)20(21,22)23;1-13-6-4-8-15(19(13)24-2)17(22)11-26-12-18(23)16-9-5-7-14(10-21)20(16)25-3;1-11-6-12(2-4-15(11)20)17(22)9-24-10-18(23)13-3-5-16(21)14(7-13)8-19;2*1-13-3-7-15(8-4-13)17(19)11-21-12-18(20)16-9-5-14(2)6-10-16;17-15(13-7-3-1-4-8-13)11-19-12-16(18)14-9-5-2-6-10-14/h3-8,17-18,27-28H,9-10H2,1-2H3;4-9,18-19,24-25H,10-11H2,1-3H3;4-9,17-18,21-23H,10-12H2,1-3H3;2-7,17-23H,8-10H2,1H3;2*3-10,17-20H,11-12H2,1-2H3;1-10,15-18H,11-12H2.
What are the key properties of 1-(3,4-dimethylphenyl)-2-[2-hydroxy-2-[4-methyl-3-(trifluoromethyl)phenyl]ethyl]sulfanylethanol;4-[1-hydroxy-2-[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]sulfanylethyl]-2-methylphenol;2-[2-hydroxy-2-[3-(hydroxymethyl)-2-methoxyphenyl]ethyl]sulfanyl-1-(2-methoxy-3-methylphenyl)ethanol;bis(2-[2-hydroxy-2-(4-methylphenyl)ethyl]sulfanyl-1-(4-methylphenyl)ethanol);2-[2-hydroxy-2-[3-methyl-5-(trifluoromethyl)phenyl]ethyl]sulfanyl-1-[3-methyl-5-(trifluoromethyl)phenyl]ethanol;2-(2-hydroxy-2-phenylethyl)sulfanyl-1-phenylethanol?
1-(3,4-dimethylphenyl)-2-[2-hydroxy-2-[4-methyl-3-(trifluoromethyl)phenyl]ethyl]sulfanylethanol;4-[1-hydroxy-2-[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]sulfanylethyl]-2-methylphenol;2-[2-hydroxy-2-[3-(hydroxymethyl)-2-methoxyphenyl]ethyl]sulfanyl-1-(2-methoxy-3-methylphenyl)ethanol;bis(2-[2-hydroxy-2-(4-methylphenyl)ethyl]sulfanyl-1-(4-methylphenyl)ethanol);2-[2-hydroxy-2-[3-methyl-5-(trifluoromethyl)phenyl]ethyl]sulfanyl-1-[3-methyl-5-(trifluoromethyl)phenyl]ethanol;2-(2-hydroxy-2-phenylethyl)sulfanyl-1-phenylethanol has a molecular weight of 2431.08 g/mol, XLogP of 27.17, 46 rotatable bonds, 18 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dimethylphenyl)-2-[2-hydroxy-2-[4-methyl-3-(trifluoromethyl)phenyl]ethyl]sulfanylethanol;4-[1-hydroxy-2-[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]sulfanylethyl]-2-methylphenol;2-[2-hydroxy-2-[3-(hydroxymethyl)-2-methoxyphenyl]ethyl]sulfanyl-1-(2-methoxy-3-methylphenyl)ethanol;bis(2-[2-hydroxy-2-(4-methylphenyl)ethyl]sulfanyl-1-(4-methylphenyl)ethanol);2-[2-hydroxy-2-[3-methyl-5-(trifluoromethyl)phenyl]ethyl]sulfanyl-1-[3-methyl-5-(trifluoromethyl)phenyl]ethanol;2-(2-hydroxy-2-phenylethyl)sulfanyl-1-phenylethanol is sourced from PubChem (CID 160698672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).