8-(3,4-dimethoxyphenyl)-5,6-dimethoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-f]chromen-10-one

C24H26O7 — CID 163059713

IUPAC8-(3,4-dimethoxyphenyl)-5,6-dimethoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-f]chromen-10-one
SMILESCOc1ccc(-c2cc(=O)c3c4c(c(OC)c(OC)c3o2)CCC(C)(C)O4)cc1OC
InChIInChI=1S/C24H26O7/c1-24(2)10-9-14-20(31-24)19-15(25)12-17(30-22(19)23(29-6)21(14)28-5)13-7-8-16(26-3)18(11-13)27-4/h7-8,11-12H,9-10H2,1-6H3
InChIKeyFOGWDFXHJJAMTF-UHFFFAOYSA-N
MW426.47 g/mol
LogP4.60
Rot. Bonds5

About 8-(3,4-dimethoxyphenyl)-5,6-dimethoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-f]chromen-10-one

8-(3,4-dimethoxyphenyl)-5,6-dimethoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-f]chromen-10-one (PubChem CID 163059713) has the molecular formula C24H26O7 and a molecular weight of 426.47 g/mol. Its IUPAC name is 8-(3,4-dimethoxyphenyl)-5,6-dimethoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-f]chromen-10-one.

Molecular Properties

Compound Name8-(3,4-dimethoxyphenyl)-5,6-dimethoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-f]chromen-10-one
PubChem CID163059713
Molecular FormulaC24H26O7
Molecular Weight426.47 g/mol
Exact Mass426.17
IUPAC Name8-(3,4-dimethoxyphenyl)-5,6-dimethoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-f]chromen-10-one
SMILESCOc1ccc(-c2cc(=O)c3c4c(c(OC)c(OC)c3o2)CCC(C)(C)O4)cc1OC
InChIInChI=1S/C24H26O7/c1-24(2)10-9-14-20(31-24)19-15(25)12-17(30-22(19)23(29-6)21(14)28-5)13-7-8-16(26-3)18(11-13)27-4/h7-8,11-12H,9-10H2,1-6H3
InChIKeyFOGWDFXHJJAMTF-UHFFFAOYSA-N
XLogP4.60
TPSA76.36 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.47
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 8-(3,4-dimethoxyphenyl)-5,6-dimethoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-f]chromen-10-one with MolForge

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Related Compounds

2-(3,4-dimethoxyphenyl)-6,7,8-trimethoxychromen-4-one
CID 44584772
5,10,11-trimethoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-a]xanthen-12-one
CID 163067078
2-(3,4-dimethoxyphenyl)-5,6,7,8-tetramethoxychromen-4-one;(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-ol
CID 11984539
2-(3,4-dimethoxyphenyl)-5,7,8-trihydroxychromen-4-one
CID 71403910
2-methoxy-5-(5,6,7,8-tetramethoxy-4-oxochromen-2-yl)benzenesulfonamide
CID 141103624
5,6,7,8-tetramethoxy-2-(4-methoxy-3-nitrophenyl)chromen-4-one
CID 44583489
2-(3,4-dimethoxyphenyl)-5,7-dimethoxychromen-4-one
CID 158796402
5,6,7,8-tetramethoxy-2-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)chromen-4-one
CID 141103639
[2-(3,4-dimethoxyphenyl)-6,7-dimethoxy-4-oxochromen-5-yl] acetate
CID 12679339
5-bromo-8-methoxy-2,2-dimethyl-3,4-dihydrochromene
CID 171049136
2-(3,4-dimethoxyphenyl)chromen-4-one
CID 158873505
2-(3,4-dimethoxyphenyl)-7-hydroxy-6-methoxychromen-4-one
CID 14235163

Frequently Asked Questions

What is the IUPAC name of 8-(3,4-dimethoxyphenyl)-5,6-dimethoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-f]chromen-10-one?
The IUPAC name of 8-(3,4-dimethoxyphenyl)-5,6-dimethoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-f]chromen-10-one (CID 163059713) is 8-(3,4-dimethoxyphenyl)-5,6-dimethoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-f]chromen-10-one.
What is the SMILES notation for 8-(3,4-dimethoxyphenyl)-5,6-dimethoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-f]chromen-10-one?
The canonical SMILES for 8-(3,4-dimethoxyphenyl)-5,6-dimethoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-f]chromen-10-one is COc1ccc(-c2cc(=O)c3c4c(c(OC)c(OC)c3o2)CCC(C)(C)O4)cc1OC.
What is the InChIKey of 8-(3,4-dimethoxyphenyl)-5,6-dimethoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-f]chromen-10-one?
The InChIKey is FOGWDFXHJJAMTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26O7/c1-24(2)10-9-14-20(31-24)19-15(25)12-17(30-22(19)23(29-6)21(14)28-5)13-7-8-16(26-3)18(11-13)27-4/h7-8,11-12H,9-10H2,1-6H3.
What are the key properties of 8-(3,4-dimethoxyphenyl)-5,6-dimethoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-f]chromen-10-one?
8-(3,4-dimethoxyphenyl)-5,6-dimethoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-f]chromen-10-one has a molecular weight of 426.47 g/mol, XLogP of 4.60, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(3,4-dimethoxyphenyl)-5,6-dimethoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-f]chromen-10-one is sourced from PubChem (CID 163059713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).