2-(furan-2-yl)-5-methoxy-8-phenylchromen-4-one

C20H14O4 — CID 6096222

IUPAC2-(furan-2-yl)-5-methoxy-8-phenylchromen-4-one
SMILESCOc1ccc(-c2ccccc2)c2oc(-c3ccco3)cc(=O)c12
InChIInChI=1S/C20H14O4/c1-22-17-10-9-14(13-6-3-2-4-7-13)20-19(17)15(21)12-18(24-20)16-8-5-11-23-16/h2-12H,1H3
InChIKeySJJMMDNOXVCOFH-UHFFFAOYSA-N
MW318.33 g/mol
LogP4.73
Rot. Bonds3

About 2-(furan-2-yl)-5-methoxy-8-phenylchromen-4-one

2-(furan-2-yl)-5-methoxy-8-phenylchromen-4-one (PubChem CID 6096222) has the molecular formula C20H14O4 and a molecular weight of 318.33 g/mol. Its IUPAC name is 2-(furan-2-yl)-5-methoxy-8-phenylchromen-4-one.

Molecular Properties

Compound Name2-(furan-2-yl)-5-methoxy-8-phenylchromen-4-one
PubChem CID6096222
Molecular FormulaC20H14O4
Molecular Weight318.33 g/mol
Exact Mass318.09
IUPAC Name2-(furan-2-yl)-5-methoxy-8-phenylchromen-4-one
SMILESCOc1ccc(-c2ccccc2)c2oc(-c3ccco3)cc(=O)c12
InChIInChI=1S/C20H14O4/c1-22-17-10-9-14(13-6-3-2-4-7-13)20-19(17)15(21)12-18(24-20)16-8-5-11-23-16/h2-12H,1H3
InChIKeySJJMMDNOXVCOFH-UHFFFAOYSA-N
XLogP4.73
TPSA52.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.33
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-5-methoxy-8-phenylchromen-4-one?
The IUPAC name of 2-(furan-2-yl)-5-methoxy-8-phenylchromen-4-one (CID 6096222) is 2-(furan-2-yl)-5-methoxy-8-phenylchromen-4-one.
What is the SMILES notation for 2-(furan-2-yl)-5-methoxy-8-phenylchromen-4-one?
The canonical SMILES for 2-(furan-2-yl)-5-methoxy-8-phenylchromen-4-one is COc1ccc(-c2ccccc2)c2oc(-c3ccco3)cc(=O)c12.
What is the InChIKey of 2-(furan-2-yl)-5-methoxy-8-phenylchromen-4-one?
The InChIKey is SJJMMDNOXVCOFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14O4/c1-22-17-10-9-14(13-6-3-2-4-7-13)20-19(17)15(21)12-18(24-20)16-8-5-11-23-16/h2-12H,1H3.
What are the key properties of 2-(furan-2-yl)-5-methoxy-8-phenylchromen-4-one?
2-(furan-2-yl)-5-methoxy-8-phenylchromen-4-one has a molecular weight of 318.33 g/mol, XLogP of 4.73, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-5-methoxy-8-phenylchromen-4-one is sourced from PubChem (CID 6096222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).