1-(2-hydroxy-4,6-dimethoxyphenyl)-1-(2,4,6-trimethoxyphenyl)propan-2-one

C20H24O7 — CID 70289976

IUPAC1-(2-hydroxy-4,6-dimethoxyphenyl)-1-(2,4,6-trimethoxyphenyl)propan-2-one
SMILESCOc1cc(O)c(C(C(C)=O)c2c(OC)cc(OC)cc2OC)c(OC)c1
InChIInChI=1S/C20H24O7/c1-11(21)18(19-14(22)7-12(23-2)8-15(19)25-4)20-16(26-5)9-13(24-3)10-17(20)27-6/h7-10,18,22H,1-6H3
InChIKeyHQAIBCRNOHCNCH-UHFFFAOYSA-N
MW376.41 g/mol
LogP3.16
Rot. Bonds8

About 1-(2-hydroxy-4,6-dimethoxyphenyl)-1-(2,4,6-trimethoxyphenyl)propan-2-one

1-(2-hydroxy-4,6-dimethoxyphenyl)-1-(2,4,6-trimethoxyphenyl)propan-2-one (PubChem CID 70289976) has the molecular formula C20H24O7 and a molecular weight of 376.41 g/mol. Its IUPAC name is 1-(2-hydroxy-4,6-dimethoxyphenyl)-1-(2,4,6-trimethoxyphenyl)propan-2-one.

Molecular Properties

Compound Name1-(2-hydroxy-4,6-dimethoxyphenyl)-1-(2,4,6-trimethoxyphenyl)propan-2-one
PubChem CID70289976
Molecular FormulaC20H24O7
Molecular Weight376.41 g/mol
Exact Mass376.15
IUPAC Name1-(2-hydroxy-4,6-dimethoxyphenyl)-1-(2,4,6-trimethoxyphenyl)propan-2-one
SMILESCOc1cc(O)c(C(C(C)=O)c2c(OC)cc(OC)cc2OC)c(OC)c1
InChIInChI=1S/C20H24O7/c1-11(21)18(19-14(22)7-12(23-2)8-15(19)25-4)20-16(26-5)9-13(24-3)10-17(20)27-6/h7-10,18,22H,1-6H3
InChIKeyHQAIBCRNOHCNCH-UHFFFAOYSA-N
XLogP3.16
TPSA83.45 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.41
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 1-(2-hydroxy-4,6-dimethoxyphenyl)-1-(2,4,6-trimethoxyphenyl)propan-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-2-amino-2-(2-hydroxy-4,6-dimethoxyphenyl)acetic acid
CID 66513076
(3R)-3-(2,4,6-trimethoxyphenyl)butan-2-one
CID 86312414
[3,5-dimethoxy-2-[1-(4-methoxyphenyl)-2-oxopropyl]phenyl] acetate
CID 70287614
2-[(1R)-1-amino-2,2-difluoroethyl]-3,5-dimethoxyphenol;hydrochloride
CID 171242035
2-[(1R)-1-amino-2-fluoroethyl]-3,5-dimethoxyphenol
CID 171226643
methyl (3R)-3-amino-3-(2-hydroxy-4,6-dimethoxyphenyl)propanoate;hydrochloride
CID 171248754
2-[(1R)-1-amino-3,3-difluoropropyl]-3,5-dimethoxyphenol;hydrochloride
CID 171313729
1-(2-hydroxy-4,6-dimethoxyphenyl)propane-1,2,3-triol
CID 170819085
2-[(1R)-1-aminopropyl]-3,5-dimethoxyphenol;hydrochloride
CID 171207080
2-[(1S)-1,2-diaminoethyl]-3,5-dimethoxyphenol;hydrochloride
CID 171207071
methyl 2-[3,5-dimethoxy-2-[1-(4-methoxyphenyl)-2-oxopropyl]phenoxy]acetate
CID 70426380
ethyl (3R)-3-amino-2-fluoro-3-(2-hydroxy-4,6-dimethoxyphenyl)propanoate;hydrochloride
CID 171242047

Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxy-4,6-dimethoxyphenyl)-1-(2,4,6-trimethoxyphenyl)propan-2-one?
The IUPAC name of 1-(2-hydroxy-4,6-dimethoxyphenyl)-1-(2,4,6-trimethoxyphenyl)propan-2-one (CID 70289976) is 1-(2-hydroxy-4,6-dimethoxyphenyl)-1-(2,4,6-trimethoxyphenyl)propan-2-one.
What is the SMILES notation for 1-(2-hydroxy-4,6-dimethoxyphenyl)-1-(2,4,6-trimethoxyphenyl)propan-2-one?
The canonical SMILES for 1-(2-hydroxy-4,6-dimethoxyphenyl)-1-(2,4,6-trimethoxyphenyl)propan-2-one is COc1cc(O)c(C(C(C)=O)c2c(OC)cc(OC)cc2OC)c(OC)c1.
What is the InChIKey of 1-(2-hydroxy-4,6-dimethoxyphenyl)-1-(2,4,6-trimethoxyphenyl)propan-2-one?
The InChIKey is HQAIBCRNOHCNCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24O7/c1-11(21)18(19-14(22)7-12(23-2)8-15(19)25-4)20-16(26-5)9-13(24-3)10-17(20)27-6/h7-10,18,22H,1-6H3.
What are the key properties of 1-(2-hydroxy-4,6-dimethoxyphenyl)-1-(2,4,6-trimethoxyphenyl)propan-2-one?
1-(2-hydroxy-4,6-dimethoxyphenyl)-1-(2,4,6-trimethoxyphenyl)propan-2-one has a molecular weight of 376.41 g/mol, XLogP of 3.16, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxy-4,6-dimethoxyphenyl)-1-(2,4,6-trimethoxyphenyl)propan-2-one is sourced from PubChem (CID 70289976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).