4-[(E)-2-(4-hydroxyphenyl)-1,2-diphenylethenyl]phenol;methane;[4-[(E)-2-(4-methoxyphenyl)-1,2-diphenylethenyl]phenyl]methanol

C56H52O4 — CID 158056261

IUPAC4-[(E)-2-(4-hydroxyphenyl)-1,2-diphenylethenyl]phenol;methane;[4-[(E)-2-(4-methoxyphenyl)-1,2-diphenylethenyl]phenyl]methanol
SMILESC.C.COc1ccc(/C(=C(\c2ccccc2)c2ccc(CO)cc2)c2ccccc2)cc1.Oc1ccc(/C(=C(\c2ccccc2)c2ccc(O)cc2)c2ccccc2)cc1
InChIInChI=1S/C28H24O2.C26H20O2.2CH4/c1-30-26-18-16-25(17-19-26)28(23-10-6-3-7-11-23)27(22-8-4-2-5-9-22)24-14-12-21(20-29)13-15-24;27-23-15-11-21(12-16-23)25(19-7-3-1-4-8-19)26(20-9-5-2-6-10-20)22-13-17-24(28)18-14-22;;/h2-19,29H,20H2,1H3;1-18,27-28H;2*1H4/b28-27+;26-25+;;
InChIKeyFKBZUSFUKWTFNZ-UUYGFRPVSA-N
MW789.03 g/mol
LogP13.57
Rot. Bonds10

About 4-[(E)-2-(4-hydroxyphenyl)-1,2-diphenylethenyl]phenol;methane;[4-[(E)-2-(4-methoxyphenyl)-1,2-diphenylethenyl]phenyl]methanol

4-[(E)-2-(4-hydroxyphenyl)-1,2-diphenylethenyl]phenol;methane;[4-[(E)-2-(4-methoxyphenyl)-1,2-diphenylethenyl]phenyl]methanol (PubChem CID 158056261) has the molecular formula C56H52O4 and a molecular weight of 789.03 g/mol. Its IUPAC name is 4-[(E)-2-(4-hydroxyphenyl)-1,2-diphenylethenyl]phenol;methane;[4-[(E)-2-(4-methoxyphenyl)-1,2-diphenylethenyl]phenyl]methanol.

Molecular Properties

Compound Name4-[(E)-2-(4-hydroxyphenyl)-1,2-diphenylethenyl]phenol;methane;[4-[(E)-2-(4-methoxyphenyl)-1,2-diphenylethenyl]phenyl]methanol
PubChem CID158056261
Molecular FormulaC56H52O4
Molecular Weight789.03 g/mol
Exact Mass788.39
IUPAC Name4-[(E)-2-(4-hydroxyphenyl)-1,2-diphenylethenyl]phenol;methane;[4-[(E)-2-(4-methoxyphenyl)-1,2-diphenylethenyl]phenyl]methanol
SMILESC.C.COc1ccc(/C(=C(\c2ccccc2)c2ccc(CO)cc2)c2ccccc2)cc1.Oc1ccc(/C(=C(\c2ccccc2)c2ccc(O)cc2)c2ccccc2)cc1
InChIInChI=1S/C28H24O2.C26H20O2.2CH4/c1-30-26-18-16-25(17-19-26)28(23-10-6-3-7-11-23)27(22-8-4-2-5-9-22)24-14-12-21(20-29)13-15-24;27-23-15-11-21(12-16-23)25(19-7-3-1-4-8-19)26(20-9-5-2-6-10-20)22-13-17-24(28)18-14-22;;/h2-19,29H,20H2,1H3;1-18,27-28H;2*1H4/b28-27+;26-25+;;
InChIKeyFKBZUSFUKWTFNZ-UUYGFRPVSA-N
XLogP13.57
TPSA69.92 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms60
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500789.03
LogP ≤ 513.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze 4-[(E)-2-(4-hydroxyphenyl)-1,2-diphenylethenyl]phenol;methane;[4-[(E)-2-(4-methoxyphenyl)-1,2-diphenylethenyl]phenyl]methanol 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

4-[2-[4-(hydroxymethyl)phenyl]-1-(4-hydroxyphenyl)-2-phenylethenyl]phenol
CID 175920876
acetic acid;4-[1-(4-methoxyphenyl)-2,2-diphenylethenyl]phenol
CID 71403634
(4-methoxyphenyl)methanol
CID 7738
[4-[1,2-bis(4-methoxyphenyl)-2-(2-propan-2-ylphenyl)ethenyl]phenyl]methanol
CID 175171881
4-(hydroxymethyl)phenol;phenol
CID 141229785
methane;4-methoxyphenol
CID 159494332
1-bromo-4-[(E)-2-(4-methoxyphenyl)-1,2-diphenylethenyl]benzene
CID 132514241
[4-[2,2-bis(4-methoxyphenyl)-1-phenylethenyl]phenyl]-phenylmethanone
CID 134955229
cycloheptane;(4-methoxyphenyl)methanol
CID 142801335
anisole;[4-(chloromethyl)phenyl]methanol
CID 163893222
benzene-1,4-diol;[4-(hydroxymethyl)phenyl]methanol;phenol;phenylmethanol
CID 160554981
benzene-1,2-diol;4-methoxyphenol
CID 70292826

Frequently Asked Questions

What is the IUPAC name of 4-[(E)-2-(4-hydroxyphenyl)-1,2-diphenylethenyl]phenol;methane;[4-[(E)-2-(4-methoxyphenyl)-1,2-diphenylethenyl]phenyl]methanol?
The IUPAC name of 4-[(E)-2-(4-hydroxyphenyl)-1,2-diphenylethenyl]phenol;methane;[4-[(E)-2-(4-methoxyphenyl)-1,2-diphenylethenyl]phenyl]methanol (CID 158056261) is 4-[(E)-2-(4-hydroxyphenyl)-1,2-diphenylethenyl]phenol;methane;[4-[(E)-2-(4-methoxyphenyl)-1,2-diphenylethenyl]phenyl]methanol.
What is the SMILES notation for 4-[(E)-2-(4-hydroxyphenyl)-1,2-diphenylethenyl]phenol;methane;[4-[(E)-2-(4-methoxyphenyl)-1,2-diphenylethenyl]phenyl]methanol?
The canonical SMILES for 4-[(E)-2-(4-hydroxyphenyl)-1,2-diphenylethenyl]phenol;methane;[4-[(E)-2-(4-methoxyphenyl)-1,2-diphenylethenyl]phenyl]methanol is C.C.COc1ccc(/C(=C(\c2ccccc2)c2ccc(CO)cc2)c2ccccc2)cc1.Oc1ccc(/C(=C(\c2ccccc2)c2ccc(O)cc2)c2ccccc2)cc1.
What is the InChIKey of 4-[(E)-2-(4-hydroxyphenyl)-1,2-diphenylethenyl]phenol;methane;[4-[(E)-2-(4-methoxyphenyl)-1,2-diphenylethenyl]phenyl]methanol?
The InChIKey is FKBZUSFUKWTFNZ-UUYGFRPVSA-N. The full InChI is InChI=1S/C28H24O2.C26H20O2.2CH4/c1-30-26-18-16-25(17-19-26)28(23-10-6-3-7-11-23)27(22-8-4-2-5-9-22)24-14-12-21(20-29)13-15-24;27-23-15-11-21(12-16-23)25(19-7-3-1-4-8-19)26(20-9-5-2-6-10-20)22-13-17-24(28)18-14-22;;/h2-19,29H,20H2,1H3;1-18,27-28H;2*1H4/b28-27+;26-25+;;.
What are the key properties of 4-[(E)-2-(4-hydroxyphenyl)-1,2-diphenylethenyl]phenol;methane;[4-[(E)-2-(4-methoxyphenyl)-1,2-diphenylethenyl]phenyl]methanol?
4-[(E)-2-(4-hydroxyphenyl)-1,2-diphenylethenyl]phenol;methane;[4-[(E)-2-(4-methoxyphenyl)-1,2-diphenylethenyl]phenyl]methanol has a molecular weight of 789.03 g/mol, XLogP of 13.57, 10 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-2-(4-hydroxyphenyl)-1,2-diphenylethenyl]phenol;methane;[4-[(E)-2-(4-methoxyphenyl)-1,2-diphenylethenyl]phenyl]methanol is sourced from PubChem (CID 158056261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).