2-(4-methoxyphenyl)-2H-furo[2,3-b]xanthene

C22H16O3 — CID 19938934

IUPAC2-(4-methoxyphenyl)-2H-furo[2,3-b]xanthene
SMILESCOc1ccc(C2C=c3cc4c(cc3O2)=Cc2ccccc2O4)cc1
InChIInChI=1S/C22H16O3/c1-23-18-8-6-14(7-9-18)20-12-17-13-21-16(11-22(17)25-20)10-15-4-2-3-5-19(15)24-21/h2-13,20H,1H3
InChIKeyKNKVRLLIONYPFH-UHFFFAOYSA-N
MW328.37 g/mol
LogP3.54
Rot. Bonds2

About 2-(4-methoxyphenyl)-2H-furo[2,3-b]xanthene

2-(4-methoxyphenyl)-2H-furo[2,3-b]xanthene (PubChem CID 19938934) has the molecular formula C22H16O3 and a molecular weight of 328.37 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-2H-furo[2,3-b]xanthene.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-2H-furo[2,3-b]xanthene
PubChem CID19938934
Molecular FormulaC22H16O3
Molecular Weight328.37 g/mol
Exact Mass328.11
IUPAC Name2-(4-methoxyphenyl)-2H-furo[2,3-b]xanthene
SMILESCOc1ccc(C2C=c3cc4c(cc3O2)=Cc2ccccc2O4)cc1
InChIInChI=1S/C22H16O3/c1-23-18-8-6-14(7-9-18)20-12-17-13-21-16(11-22(17)25-20)10-15-4-2-3-5-19(15)24-21/h2-13,20H,1H3
InChIKeyKNKVRLLIONYPFH-UHFFFAOYSA-N
XLogP3.54
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-2H-furo[2,3-b]xanthene?
The IUPAC name of 2-(4-methoxyphenyl)-2H-furo[2,3-b]xanthene (CID 19938934) is 2-(4-methoxyphenyl)-2H-furo[2,3-b]xanthene.
What is the SMILES notation for 2-(4-methoxyphenyl)-2H-furo[2,3-b]xanthene?
The canonical SMILES for 2-(4-methoxyphenyl)-2H-furo[2,3-b]xanthene is COc1ccc(C2C=c3cc4c(cc3O2)=Cc2ccccc2O4)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-2H-furo[2,3-b]xanthene?
The InChIKey is KNKVRLLIONYPFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16O3/c1-23-18-8-6-14(7-9-18)20-12-17-13-21-16(11-22(17)25-20)10-15-4-2-3-5-19(15)24-21/h2-13,20H,1H3.
What are the key properties of 2-(4-methoxyphenyl)-2H-furo[2,3-b]xanthene?
2-(4-methoxyphenyl)-2H-furo[2,3-b]xanthene has a molecular weight of 328.37 g/mol, XLogP of 3.54, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-2H-furo[2,3-b]xanthene is sourced from PubChem (CID 19938934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).