4-methyl-2-(4-methylphenyl)-3-phenyl-2H-chromen-7-ol

C23H20O2 — CID 176984968

IUPAC4-methyl-2-(4-methylphenyl)-3-phenyl-2H-chromen-7-ol
SMILESCC1=C(c2ccccc2)C(c2ccc(C)cc2)Oc2cc(O)ccc21
InChIInChI=1S/C23H20O2/c1-15-8-10-18(11-9-15)23-22(17-6-4-3-5-7-17)16(2)20-13-12-19(24)14-21(20)25-23/h3-14,23-24H,1-2H3
InChIKeyNWFUFOIMSDYXPC-UHFFFAOYSA-N
MW328.41 g/mol
LogP5.77
Rot. Bonds2

About 4-methyl-2-(4-methylphenyl)-3-phenyl-2H-chromen-7-ol

4-methyl-2-(4-methylphenyl)-3-phenyl-2H-chromen-7-ol (PubChem CID 176984968) has the molecular formula C23H20O2 and a molecular weight of 328.41 g/mol. Its IUPAC name is 4-methyl-2-(4-methylphenyl)-3-phenyl-2H-chromen-7-ol.

Molecular Properties

Compound Name4-methyl-2-(4-methylphenyl)-3-phenyl-2H-chromen-7-ol
PubChem CID176984968
Molecular FormulaC23H20O2
Molecular Weight328.41 g/mol
Exact Mass328.15
IUPAC Name4-methyl-2-(4-methylphenyl)-3-phenyl-2H-chromen-7-ol
SMILESCC1=C(c2ccccc2)C(c2ccc(C)cc2)Oc2cc(O)ccc21
InChIInChI=1S/C23H20O2/c1-15-8-10-18(11-9-15)23-22(17-6-4-3-5-7-17)16(2)20-13-12-19(24)14-21(20)25-23/h3-14,23-24H,1-2H3
InChIKeyNWFUFOIMSDYXPC-UHFFFAOYSA-N
XLogP5.77
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.41
LogP ≤ 55.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(3,5-difluorophenyl)-4-methyl-2-(4-methylphenyl)-2H-chromen-7-ol
CID 155589063
ethane;4-[2-(4-ethylphenyl)-4-methyl-2H-chromen-3-yl]phenol
CID 167478950
3-(4-hydroxyphenyl)-2,4-dimethyl-2H-chromen-7-ol
CID 145178984
(2S)-3-(4-hydroxyphenyl)-4-methyl-2-[4-(1-propylazetidin-3-yl)oxyphenyl]-2H-chromen-7-ol;sulfane
CID 159375224
2-[4-[dideuterio-[1-(3,3,3-trideuteriopropyl)azetidin-3-yl]methyl]phenyl]-3-(4-hydroxyphenyl)-4-methyl-2H-chromen-7-ol
CID 122644364
2-[4-[2-[3-(fluoromethyl)azetidin-1-yl]ethoxy]phenyl]-4-methyl-3-phenyl-2H-chromen-6-ol
CID 71609797
(2R)-2-[3-fluoro-4-[(1-propylazetidin-3-yl)methyl]phenyl]-3-(4-hydroxyphenyl)-4-methyl-2H-chromen-7-ol
CID 122644402
(2S)-2-[3-fluoro-4-(1-propylazetidin-3-yl)oxyphenyl]-3-(4-hydroxyphenyl)-4-methyl-2H-chromen-7-ol
CID 122644392
4-[2-[4-[2-[3-(fluoromethyl)azetidin-1-yl]ethoxy]phenyl]-7-hydroxy-4-methyl-2H-chromen-3-yl]benzonitrile
CID 86764356
1-[2-[4-[4,7-dimethyl-3-(4-methylphenyl)-2H-chromen-2-yl]phenoxy]ethyl]pyrrolidin-1-ium
CID 54023147
2-[4-[deuterio-[1-(3,3,3-trideuteriopropyl)azetidin-3-yl]methyl]phenyl]-3-(4-hydroxyphenyl)-4-(trideuteriomethyl)-2H-chromen-7-ol
CID 122644360
2-[4-[3-deuterio-1-(3,3-dideuteriopropyl)azetidin-3-yl]sulfanylphenyl]-3-(4-hydroxyphenyl)-4-(trideuteriomethyl)-2H-chromen-7-ol
CID 122644379

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(4-methylphenyl)-3-phenyl-2H-chromen-7-ol?
The IUPAC name of 4-methyl-2-(4-methylphenyl)-3-phenyl-2H-chromen-7-ol (CID 176984968) is 4-methyl-2-(4-methylphenyl)-3-phenyl-2H-chromen-7-ol.
What is the SMILES notation for 4-methyl-2-(4-methylphenyl)-3-phenyl-2H-chromen-7-ol?
The canonical SMILES for 4-methyl-2-(4-methylphenyl)-3-phenyl-2H-chromen-7-ol is CC1=C(c2ccccc2)C(c2ccc(C)cc2)Oc2cc(O)ccc21.
What is the InChIKey of 4-methyl-2-(4-methylphenyl)-3-phenyl-2H-chromen-7-ol?
The InChIKey is NWFUFOIMSDYXPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20O2/c1-15-8-10-18(11-9-15)23-22(17-6-4-3-5-7-17)16(2)20-13-12-19(24)14-21(20)25-23/h3-14,23-24H,1-2H3.
What are the key properties of 4-methyl-2-(4-methylphenyl)-3-phenyl-2H-chromen-7-ol?
4-methyl-2-(4-methylphenyl)-3-phenyl-2H-chromen-7-ol has a molecular weight of 328.41 g/mol, XLogP of 5.77, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(4-methylphenyl)-3-phenyl-2H-chromen-7-ol is sourced from PubChem (CID 176984968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).