(6-methoxy-1-benzofuran-2-yl)-(3,4,5-trimethoxyphenyl)methanone

C19H18O6 — CID 46226723

IUPAC(6-methoxy-1-benzofuran-2-yl)-(3,4,5-trimethoxyphenyl)methanone
SMILESCOc1ccc2cc(C(=O)c3cc(OC)c(OC)c(OC)c3)oc2c1
InChIInChI=1S/C19H18O6/c1-21-13-6-5-11-7-15(25-14(11)10-13)18(20)12-8-16(22-2)19(24-4)17(9-12)23-3/h5-10H,1-4H3
InChIKeyLSHNKPWXTNLQGT-UHFFFAOYSA-N
MW342.35 g/mol
LogP3.70
Rot. Bonds6

About (6-methoxy-1-benzofuran-2-yl)-(3,4,5-trimethoxyphenyl)methanone

(6-methoxy-1-benzofuran-2-yl)-(3,4,5-trimethoxyphenyl)methanone (PubChem CID 46226723) has the molecular formula C19H18O6 and a molecular weight of 342.35 g/mol. Its IUPAC name is (6-methoxy-1-benzofuran-2-yl)-(3,4,5-trimethoxyphenyl)methanone.

Molecular Properties

Compound Name(6-methoxy-1-benzofuran-2-yl)-(3,4,5-trimethoxyphenyl)methanone
PubChem CID46226723
Molecular FormulaC19H18O6
Molecular Weight342.35 g/mol
Exact Mass342.11
IUPAC Name(6-methoxy-1-benzofuran-2-yl)-(3,4,5-trimethoxyphenyl)methanone
SMILESCOc1ccc2cc(C(=O)c3cc(OC)c(OC)c(OC)c3)oc2c1
InChIInChI=1S/C19H18O6/c1-21-13-6-5-11-7-15(25-14(11)10-13)18(20)12-8-16(22-2)19(24-4)17(9-12)23-3/h5-10H,1-4H3
InChIKeyLSHNKPWXTNLQGT-UHFFFAOYSA-N
XLogP3.70
TPSA67.13 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.35
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

[6-methoxy-3-(4-methoxyphenyl)-1-benzofuran-2-yl]-(3,4,5-trimethoxyphenyl)methanone
CID 22592534
(3-bromo-4-fluorophenyl)-(6-methoxy-1-benzofuran-2-yl)methanone
CID 62915012
2-chloro-N-[6-methoxy-2-(3,4,5-trimethoxybenzoyl)-1-benzofuran-3-yl]acetamide
CID 44579692
2-chloro-5-(6-methoxy-1-benzofuran-2-carbonyl)benzenesulfonamide
CID 21316621
7-methoxy-3-(3,4,5-trimethoxyphenyl)chromen-2-one
CID 155816497
(3-ethylazulen-1-yl)-(6-methoxy-1-benzofuran-2-yl)methanone
CID 11012943
(6,7-dimethoxy-1-benzofuran-2-yl)-(3-methoxyphenyl)methanone
CID 155803415
(3-methoxyphenyl)-(3,4,5-trimethoxyphenyl)methanone
CID 10902719
(4-chlorophenyl)-(5-methoxy-1-benzofuran-2-yl)methanone
CID 2797594
(7-methoxy-2-oxochromen-4-yl)methyl 3,4,5-trimethoxybenzoate
CID 3971708
(6-methoxy-1-benzofuran-2-carbonyl)oxymethylphosphonic acid
CID 150972159
[6-(diethylamino)-1-benzofuran-2-yl]-(3-methoxyphenyl)methanone
CID 11551551

Frequently Asked Questions

What is the IUPAC name of (6-methoxy-1-benzofuran-2-yl)-(3,4,5-trimethoxyphenyl)methanone?
The IUPAC name of (6-methoxy-1-benzofuran-2-yl)-(3,4,5-trimethoxyphenyl)methanone (CID 46226723) is (6-methoxy-1-benzofuran-2-yl)-(3,4,5-trimethoxyphenyl)methanone.
What is the SMILES notation for (6-methoxy-1-benzofuran-2-yl)-(3,4,5-trimethoxyphenyl)methanone?
The canonical SMILES for (6-methoxy-1-benzofuran-2-yl)-(3,4,5-trimethoxyphenyl)methanone is COc1ccc2cc(C(=O)c3cc(OC)c(OC)c(OC)c3)oc2c1.
What is the InChIKey of (6-methoxy-1-benzofuran-2-yl)-(3,4,5-trimethoxyphenyl)methanone?
The InChIKey is LSHNKPWXTNLQGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18O6/c1-21-13-6-5-11-7-15(25-14(11)10-13)18(20)12-8-16(22-2)19(24-4)17(9-12)23-3/h5-10H,1-4H3.
What are the key properties of (6-methoxy-1-benzofuran-2-yl)-(3,4,5-trimethoxyphenyl)methanone?
(6-methoxy-1-benzofuran-2-yl)-(3,4,5-trimethoxyphenyl)methanone has a molecular weight of 342.35 g/mol, XLogP of 3.70, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methoxy-1-benzofuran-2-yl)-(3,4,5-trimethoxyphenyl)methanone is sourced from PubChem (CID 46226723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).