7-methoxy-2,4-diphenyl-4H-chromene

C22H18O2 — CID 10380919

IUPAC7-methoxy-2,4-diphenyl-4H-chromene
SMILESCOc1ccc2c(c1)OC(c1ccccc1)=CC2c1ccccc1
InChIInChI=1S/C22H18O2/c1-23-18-12-13-19-20(16-8-4-2-5-9-16)15-21(24-22(19)14-18)17-10-6-3-7-11-17/h2-15,20H,1H3
InChIKeyZIYBQVBZDBTXCR-UHFFFAOYSA-N
MW314.38 g/mol
LogP5.26
Rot. Bonds3

About 7-methoxy-2,4-diphenyl-4H-chromene

7-methoxy-2,4-diphenyl-4H-chromene (PubChem CID 10380919) has the molecular formula C22H18O2 and a molecular weight of 314.38 g/mol. Its IUPAC name is 7-methoxy-2,4-diphenyl-4H-chromene.

Molecular Properties

Compound Name7-methoxy-2,4-diphenyl-4H-chromene
PubChem CID10380919
Molecular FormulaC22H18O2
Molecular Weight314.38 g/mol
Exact Mass314.13
IUPAC Name7-methoxy-2,4-diphenyl-4H-chromene
SMILESCOc1ccc2c(c1)OC(c1ccccc1)=CC2c1ccccc1
InChIInChI=1S/C22H18O2/c1-23-18-12-13-19-20(16-8-4-2-5-9-16)15-21(24-22(19)14-18)17-10-6-3-7-11-17/h2-15,20H,1H3
InChIKeyZIYBQVBZDBTXCR-UHFFFAOYSA-N
XLogP5.26
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.38
LogP ≤ 55.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-2,4-diphenyl-4H-chromene?
The IUPAC name of 7-methoxy-2,4-diphenyl-4H-chromene (CID 10380919) is 7-methoxy-2,4-diphenyl-4H-chromene.
What is the SMILES notation for 7-methoxy-2,4-diphenyl-4H-chromene?
The canonical SMILES for 7-methoxy-2,4-diphenyl-4H-chromene is COc1ccc2c(c1)OC(c1ccccc1)=CC2c1ccccc1.
What is the InChIKey of 7-methoxy-2,4-diphenyl-4H-chromene?
The InChIKey is ZIYBQVBZDBTXCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18O2/c1-23-18-12-13-19-20(16-8-4-2-5-9-16)15-21(24-22(19)14-18)17-10-6-3-7-11-17/h2-15,20H,1H3.
What are the key properties of 7-methoxy-2,4-diphenyl-4H-chromene?
7-methoxy-2,4-diphenyl-4H-chromene has a molecular weight of 314.38 g/mol, XLogP of 5.26, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-2,4-diphenyl-4H-chromene is sourced from PubChem (CID 10380919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).