2-methoxy-5-[[(3R)-5,6,7-trimethoxy-3,4-dihydro-2H-chromen-3-yl]methyl]phenol

C20H24O6 — CID 155755652

IUPAC2-methoxy-5-[[(3R)-5,6,7-trimethoxy-3,4-dihydro-2H-chromen-3-yl]methyl]phenol
SMILESCOc1ccc(C[C@H]2COc3cc(OC)c(OC)c(OC)c3C2)cc1O
InChIInChI=1S/C20H24O6/c1-22-16-6-5-12(9-15(16)21)7-13-8-14-17(26-11-13)10-18(23-2)20(25-4)19(14)24-3/h5-6,9-10,13,21H,7-8,11H2,1-4H3/t13-/m1/s1
InChIKeyRACFGZBMVCDIDQ-CYBMUJFWSA-N
MW360.41 g/mol
LogP3.22
Rot. Bonds6

About 2-methoxy-5-[[(3R)-5,6,7-trimethoxy-3,4-dihydro-2H-chromen-3-yl]methyl]phenol

2-methoxy-5-[[(3R)-5,6,7-trimethoxy-3,4-dihydro-2H-chromen-3-yl]methyl]phenol (PubChem CID 155755652) has the molecular formula C20H24O6 and a molecular weight of 360.41 g/mol. Its IUPAC name is 2-methoxy-5-[[(3R)-5,6,7-trimethoxy-3,4-dihydro-2H-chromen-3-yl]methyl]phenol.

Molecular Properties

Compound Name2-methoxy-5-[[(3R)-5,6,7-trimethoxy-3,4-dihydro-2H-chromen-3-yl]methyl]phenol
PubChem CID155755652
Molecular FormulaC20H24O6
Molecular Weight360.41 g/mol
Exact Mass360.16
IUPAC Name2-methoxy-5-[[(3R)-5,6,7-trimethoxy-3,4-dihydro-2H-chromen-3-yl]methyl]phenol
SMILESCOc1ccc(C[C@H]2COc3cc(OC)c(OC)c(OC)c3C2)cc1O
InChIInChI=1S/C20H24O6/c1-22-16-6-5-12(9-15(16)21)7-13-8-14-17(26-11-13)10-18(23-2)20(25-4)19(14)24-3/h5-6,9-10,13,21H,7-8,11H2,1-4H3/t13-/m1/s1
InChIKeyRACFGZBMVCDIDQ-CYBMUJFWSA-N
XLogP3.22
TPSA66.38 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.41
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-methoxy-5-[[(3R)-5,6,7-trimethoxy-3,4-dihydro-2H-chromen-3-yl]methyl]phenol 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

5-[(5,7-dimethoxy-3,4-dihydro-2H-chromen-3-yl)methyl]-2-methoxyphenol
CID 155755624
5-(cyclopropylmethyl)-2-methoxyphenol
CID 115015182
2-[butyl-[2-methoxy-5-[(5,6,7-trimethoxy-3,4-dihydro-2H-chromen-3-yl)methyl]phenoxy]carbonylamino]acetic acid
CID 175884760
[2-methoxy-5-[(5,6,7-trimethoxy-3,4-dihydro-2H-chromen-3-yl)methyl]phenyl] 5-(dithiolan-3-yl)pentanoate
CID 155755599
5,6,7-triethoxy-3-[(4-ethoxy-3-fluorophenyl)methyl]-3,4-dihydro-2H-chromene
CID 155755683
(3R)-5,7-dihydroxy-3-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2,3-dihydrochromen-4-one
CID 162921322
6-chloro-3-[(3-hydroxy-4-methoxyphenyl)methyl]-2,3-dihydrochromen-4-one
CID 69167667
(3S,4S)-3-[(3-hydroxy-4-methoxyphenyl)methyl]-4-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one
CID 11210543
5-[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)methyl]-2-methoxyphenol;hydrochloride
CID 69043813
(3R,4R)-4-[(3-hydroxy-4-methoxyphenyl)methyl]-3-[(3-hydroxyphenyl)methyl]oxolan-2-one
CID 11131264
(3R,4R)-4-[(S)-hydroxy-(3-hydroxy-4-methoxyphenyl)methyl]-3-[(3-hydroxy-4-methoxyphenyl)methyl]oxolan-2-one
CID 11581568
4-[hydroxy-(3-hydroxy-4-methoxyphenyl)methyl]-3-[(3-hydroxy-4-methoxyphenyl)methyl]oxolan-2-one
CID 73018881

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-[[(3R)-5,6,7-trimethoxy-3,4-dihydro-2H-chromen-3-yl]methyl]phenol?
The IUPAC name of 2-methoxy-5-[[(3R)-5,6,7-trimethoxy-3,4-dihydro-2H-chromen-3-yl]methyl]phenol (CID 155755652) is 2-methoxy-5-[[(3R)-5,6,7-trimethoxy-3,4-dihydro-2H-chromen-3-yl]methyl]phenol.
What is the SMILES notation for 2-methoxy-5-[[(3R)-5,6,7-trimethoxy-3,4-dihydro-2H-chromen-3-yl]methyl]phenol?
The canonical SMILES for 2-methoxy-5-[[(3R)-5,6,7-trimethoxy-3,4-dihydro-2H-chromen-3-yl]methyl]phenol is COc1ccc(C[C@H]2COc3cc(OC)c(OC)c(OC)c3C2)cc1O.
What is the InChIKey of 2-methoxy-5-[[(3R)-5,6,7-trimethoxy-3,4-dihydro-2H-chromen-3-yl]methyl]phenol?
The InChIKey is RACFGZBMVCDIDQ-CYBMUJFWSA-N. The full InChI is InChI=1S/C20H24O6/c1-22-16-6-5-12(9-15(16)21)7-13-8-14-17(26-11-13)10-18(23-2)20(25-4)19(14)24-3/h5-6,9-10,13,21H,7-8,11H2,1-4H3/t13-/m1/s1.
What are the key properties of 2-methoxy-5-[[(3R)-5,6,7-trimethoxy-3,4-dihydro-2H-chromen-3-yl]methyl]phenol?
2-methoxy-5-[[(3R)-5,6,7-trimethoxy-3,4-dihydro-2H-chromen-3-yl]methyl]phenol has a molecular weight of 360.41 g/mol, XLogP of 3.22, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-[[(3R)-5,6,7-trimethoxy-3,4-dihydro-2H-chromen-3-yl]methyl]phenol is sourced from PubChem (CID 155755652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).