7-methoxy-3-(4-methoxyphenyl)-6-methylchromen-4-one

C18H16O4 — CID 57363360

IUPAC7-methoxy-3-(4-methoxyphenyl)-6-methylchromen-4-one
SMILESCOc1ccc(-c2coc3cc(OC)c(C)cc3c2=O)cc1
InChIInChI=1S/C18H16O4/c1-11-8-14-17(9-16(11)21-3)22-10-15(18(14)19)12-4-6-13(20-2)7-5-12/h4-10H,1-3H3
InChIKeyCLIGLZFHCSOGSY-UHFFFAOYSA-N
MW296.32 g/mol
LogP3.79
Rot. Bonds3

About 7-methoxy-3-(4-methoxyphenyl)-6-methylchromen-4-one

7-methoxy-3-(4-methoxyphenyl)-6-methylchromen-4-one (PubChem CID 57363360) has the molecular formula C18H16O4 and a molecular weight of 296.32 g/mol. Its IUPAC name is 7-methoxy-3-(4-methoxyphenyl)-6-methylchromen-4-one.

Molecular Properties

Compound Name7-methoxy-3-(4-methoxyphenyl)-6-methylchromen-4-one
PubChem CID57363360
Molecular FormulaC18H16O4
Molecular Weight296.32 g/mol
Exact Mass296.10
IUPAC Name7-methoxy-3-(4-methoxyphenyl)-6-methylchromen-4-one
SMILESCOc1ccc(-c2coc3cc(OC)c(C)cc3c2=O)cc1
InChIInChI=1S/C18H16O4/c1-11-8-14-17(9-16(11)21-3)22-10-15(18(14)19)12-4-6-13(20-2)7-5-12/h4-10H,1-3H3
InChIKeyCLIGLZFHCSOGSY-UHFFFAOYSA-N
XLogP3.79
TPSA48.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.32
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

7-methoxy-3-(4-methoxyphenyl)chromen-4-one
CID 46702269
6-ethyl-7-methoxy-3-(4-methylphenyl)chromen-4-one
CID 58480721
3-(3,4-dimethoxyphenyl)-6,7-dimethoxychromen-4-one
CID 631176
6,7-dimethoxy-3-(3-methoxyphenyl)chromen-4-one
CID 15228899
3-(4-aminophenyl)-6,7-dimethylchromen-4-one
CID 119106347
5-hydroxy-6,7-dimethoxy-3-(4-methoxyphenyl)chromen-4-one
CID 10830108
3,7-bis(4-methylphenyl)pyrano[3,2-g]chromene-4,6-dione
CID 15320936
6-methoxy-3-(4-methoxyphenyl)-7-[(2R,3R,4S,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]oxychromen-4-one
CID 163185974
6-hydroxy-3-(4-hydroxy-3-methoxyphenyl)-7-methylchromen-4-one
CID 42604870
3-(4-methoxyphenyl)-7-(oxiran-2-ylmethoxy)chromen-4-one
CID 86618198
3-(4-methoxyphenyl)-5-methylfuro[3,2-g]chromen-7-one
CID 707742
3-(3,4-dimethoxyphenyl)-6,7-dihydroxychromen-4-one
CID 21270169

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-3-(4-methoxyphenyl)-6-methylchromen-4-one?
The IUPAC name of 7-methoxy-3-(4-methoxyphenyl)-6-methylchromen-4-one (CID 57363360) is 7-methoxy-3-(4-methoxyphenyl)-6-methylchromen-4-one.
What is the SMILES notation for 7-methoxy-3-(4-methoxyphenyl)-6-methylchromen-4-one?
The canonical SMILES for 7-methoxy-3-(4-methoxyphenyl)-6-methylchromen-4-one is COc1ccc(-c2coc3cc(OC)c(C)cc3c2=O)cc1.
What is the InChIKey of 7-methoxy-3-(4-methoxyphenyl)-6-methylchromen-4-one?
The InChIKey is CLIGLZFHCSOGSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16O4/c1-11-8-14-17(9-16(11)21-3)22-10-15(18(14)19)12-4-6-13(20-2)7-5-12/h4-10H,1-3H3.
What are the key properties of 7-methoxy-3-(4-methoxyphenyl)-6-methylchromen-4-one?
7-methoxy-3-(4-methoxyphenyl)-6-methylchromen-4-one has a molecular weight of 296.32 g/mol, XLogP of 3.79, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-3-(4-methoxyphenyl)-6-methylchromen-4-one is sourced from PubChem (CID 57363360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).