6,7-dimethoxy-2-(4-methoxyphenyl)-5,8-dimethylchromen-4-one

C20H20O5 — CID 145159791

IUPAC6,7-dimethoxy-2-(4-methoxyphenyl)-5,8-dimethylchromen-4-one
SMILESCOc1ccc(-c2cc(=O)c3c(C)c(OC)c(OC)c(C)c3o2)cc1
InChIInChI=1S/C20H20O5/c1-11-17-15(21)10-16(13-6-8-14(22-3)9-7-13)25-18(17)12(2)20(24-5)19(11)23-4/h6-10H,1-5H3
InChIKeyPLYNKDXICKZGJK-UHFFFAOYSA-N
MW340.38 g/mol
LogP4.10
Rot. Bonds4

About 6,7-dimethoxy-2-(4-methoxyphenyl)-5,8-dimethylchromen-4-one

6,7-dimethoxy-2-(4-methoxyphenyl)-5,8-dimethylchromen-4-one (PubChem CID 145159791) has the molecular formula C20H20O5 and a molecular weight of 340.38 g/mol. Its IUPAC name is 6,7-dimethoxy-2-(4-methoxyphenyl)-5,8-dimethylchromen-4-one.

Molecular Properties

Compound Name6,7-dimethoxy-2-(4-methoxyphenyl)-5,8-dimethylchromen-4-one
PubChem CID145159791
Molecular FormulaC20H20O5
Molecular Weight340.38 g/mol
Exact Mass340.13
IUPAC Name6,7-dimethoxy-2-(4-methoxyphenyl)-5,8-dimethylchromen-4-one
SMILESCOc1ccc(-c2cc(=O)c3c(C)c(OC)c(OC)c(C)c3o2)cc1
InChIInChI=1S/C20H20O5/c1-11-17-15(21)10-16(13-6-8-14(22-3)9-7-13)25-18(17)12(2)20(24-5)19(11)23-4/h6-10H,1-5H3
InChIKeyPLYNKDXICKZGJK-UHFFFAOYSA-N
XLogP4.10
TPSA57.90 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

8-bromo-5-hydroxy-6,7-dimethoxy-2-(4-methoxyphenyl)chromen-4-one
CID 15870477
4,9,14-tris(4-methoxyphenyl)-3,8,13-trioxatetracyclo[10.3.0.02,6.07,11]pentadeca-1,4,6,9,11,14-hexaene
CID 102345821
2-(3,4-dihydroxyphenyl)-5-hydroxy-7-methoxy-6,8-dimethylchromen-4-one
CID 10065066
7-hydroxy-5,8-dimethoxy-2-(4-methoxyphenyl)-4-oxochromene-6-sulfonic acid
CID 102584177
[7,8-dimethoxy-2-(4-methoxyphenyl)-4-oxochromen-5-yl] acetate
CID 23259396
6,8-difluoro-2-(4-methoxyphenyl)chromen-4-one
CID 171716334
6,8-diamino-2-(4-methoxyphenyl)chromen-4-one
CID 139992876
6,7,8-trihydroxy-2-(4-methoxyphenyl)chromen-4-one
CID 16657777
6,7-dimethoxy-2-[4-(4-methoxyphenyl)phenyl]chromen-4-one
CID 155754088
7-hydroxy-2-(4-methoxyphenyl)-4-oxochromen-8-olate
CID 164575986
8-ethyl-5,7-dihydroxy-2-(4-methoxyphenyl)chromen-4-one
CID 130427398
7-hydroxy-8-[[7-hydroxy-2-(4-methoxyphenyl)-4-oxochromen-8-yl]methyl]-2-(4-methoxyphenyl)chromen-4-one
CID 91431770

Frequently Asked Questions

What is the IUPAC name of 6,7-dimethoxy-2-(4-methoxyphenyl)-5,8-dimethylchromen-4-one?
The IUPAC name of 6,7-dimethoxy-2-(4-methoxyphenyl)-5,8-dimethylchromen-4-one (CID 145159791) is 6,7-dimethoxy-2-(4-methoxyphenyl)-5,8-dimethylchromen-4-one.
What is the SMILES notation for 6,7-dimethoxy-2-(4-methoxyphenyl)-5,8-dimethylchromen-4-one?
The canonical SMILES for 6,7-dimethoxy-2-(4-methoxyphenyl)-5,8-dimethylchromen-4-one is COc1ccc(-c2cc(=O)c3c(C)c(OC)c(OC)c(C)c3o2)cc1.
What is the InChIKey of 6,7-dimethoxy-2-(4-methoxyphenyl)-5,8-dimethylchromen-4-one?
The InChIKey is PLYNKDXICKZGJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20O5/c1-11-17-15(21)10-16(13-6-8-14(22-3)9-7-13)25-18(17)12(2)20(24-5)19(11)23-4/h6-10H,1-5H3.
What are the key properties of 6,7-dimethoxy-2-(4-methoxyphenyl)-5,8-dimethylchromen-4-one?
6,7-dimethoxy-2-(4-methoxyphenyl)-5,8-dimethylchromen-4-one has a molecular weight of 340.38 g/mol, XLogP of 4.10, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethoxy-2-(4-methoxyphenyl)-5,8-dimethylchromen-4-one is sourced from PubChem (CID 145159791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).