6,7-dimethoxy-2-[4-(4-methoxyphenyl)phenyl]chromen-4-one

C24H20O5 — CID 155754088

IUPAC6,7-dimethoxy-2-[4-(4-methoxyphenyl)phenyl]chromen-4-one
SMILESCOc1ccc(-c2ccc(-c3cc(=O)c4cc(OC)c(OC)cc4o3)cc2)cc1
InChIInChI=1S/C24H20O5/c1-26-18-10-8-16(9-11-18)15-4-6-17(7-5-15)21-13-20(25)19-12-23(27-2)24(28-3)14-22(19)29-21/h4-14H,1-3H3
InChIKeyZYFFPGMQUJXMKI-UHFFFAOYSA-N
MW388.42 g/mol
LogP5.15
Rot. Bonds5

About 6,7-dimethoxy-2-[4-(4-methoxyphenyl)phenyl]chromen-4-one

6,7-dimethoxy-2-[4-(4-methoxyphenyl)phenyl]chromen-4-one (PubChem CID 155754088) has the molecular formula C24H20O5 and a molecular weight of 388.42 g/mol. Its IUPAC name is 6,7-dimethoxy-2-[4-(4-methoxyphenyl)phenyl]chromen-4-one.

Molecular Properties

Compound Name6,7-dimethoxy-2-[4-(4-methoxyphenyl)phenyl]chromen-4-one
PubChem CID155754088
Molecular FormulaC24H20O5
Molecular Weight388.42 g/mol
Exact Mass388.13
IUPAC Name6,7-dimethoxy-2-[4-(4-methoxyphenyl)phenyl]chromen-4-one
SMILESCOc1ccc(-c2ccc(-c3cc(=O)c4cc(OC)c(OC)cc4o3)cc2)cc1
InChIInChI=1S/C24H20O5/c1-26-18-10-8-16(9-11-18)15-4-6-17(7-5-15)21-13-20(25)19-12-23(27-2)24(28-3)14-22(19)29-21/h4-14H,1-3H3
InChIKeyZYFFPGMQUJXMKI-UHFFFAOYSA-N
XLogP5.15
TPSA57.90 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.42
LogP ≤ 55.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6,7-dimethoxy-2-[4-(pyrrolidin-1-ylmethyl)phenyl]chromen-4-one
CID 118708574
6,7-dimethoxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one
CID 71436763
2-(4-bromophenyl)-7-methoxychromen-4-one
CID 25032618
2-(3,4-dimethoxyphenyl)-7-hydroxy-6-methoxychromen-4-one
CID 14235163
6-amino-2-(3,4-dimethoxyphenyl)-7-methoxychromen-4-one
CID 72705992
2-(4-tert-butylphenyl)-6-methoxychromen-4-one
CID 776400
2-(4-methoxyphenyl)pyrano[2,3-c]pyridin-4-one
CID 53487406
7-methoxy-2-(3-methoxyphenyl)-6-methylchromen-4-one
CID 134910542
6-methoxy-2-phenylchromen-4-one;hydrate
CID 174958280
2-(4-methoxyphenyl)-11H-pyrano[3,2-b]acridine-4,6-dione
CID 101038958
2-(6-methoxynaphthalen-2-yl)chromen-4-one
CID 132606136
2-(4-methoxyphenyl)-6-tributylstannylchromen-4-one
CID 11671100

Frequently Asked Questions

What is the IUPAC name of 6,7-dimethoxy-2-[4-(4-methoxyphenyl)phenyl]chromen-4-one?
The IUPAC name of 6,7-dimethoxy-2-[4-(4-methoxyphenyl)phenyl]chromen-4-one (CID 155754088) is 6,7-dimethoxy-2-[4-(4-methoxyphenyl)phenyl]chromen-4-one.
What is the SMILES notation for 6,7-dimethoxy-2-[4-(4-methoxyphenyl)phenyl]chromen-4-one?
The canonical SMILES for 6,7-dimethoxy-2-[4-(4-methoxyphenyl)phenyl]chromen-4-one is COc1ccc(-c2ccc(-c3cc(=O)c4cc(OC)c(OC)cc4o3)cc2)cc1.
What is the InChIKey of 6,7-dimethoxy-2-[4-(4-methoxyphenyl)phenyl]chromen-4-one?
The InChIKey is ZYFFPGMQUJXMKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20O5/c1-26-18-10-8-16(9-11-18)15-4-6-17(7-5-15)21-13-20(25)19-12-23(27-2)24(28-3)14-22(19)29-21/h4-14H,1-3H3.
What are the key properties of 6,7-dimethoxy-2-[4-(4-methoxyphenyl)phenyl]chromen-4-one?
6,7-dimethoxy-2-[4-(4-methoxyphenyl)phenyl]chromen-4-one has a molecular weight of 388.42 g/mol, XLogP of 5.15, 5 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-(4-methoxyphenyl)phenyl]chromen-4-one is sourced from PubChem (CID 155754088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).