6-(3,4-dimethoxyphenyl)-4-(3-methoxyphenyl)quinazoline

C23H20N2O3 — CID 25054919

IUPAC6-(3,4-dimethoxyphenyl)-4-(3-methoxyphenyl)quinazoline
SMILESCOc1cccc(-c2ncnc3ccc(-c4ccc(OC)c(OC)c4)cc23)c1
InChIInChI=1S/C23H20N2O3/c1-26-18-6-4-5-17(11-18)23-19-12-15(7-9-20(19)24-14-25-23)16-8-10-21(27-2)22(13-16)28-3/h4-14H,1-3H3
InChIKeyASLZYEWIGPWAIG-UHFFFAOYSA-N
MW372.42 g/mol
LogP4.99
Rot. Bonds5

About 6-(3,4-dimethoxyphenyl)-4-(3-methoxyphenyl)quinazoline

6-(3,4-dimethoxyphenyl)-4-(3-methoxyphenyl)quinazoline (PubChem CID 25054919) has the molecular formula C23H20N2O3 and a molecular weight of 372.42 g/mol. Its IUPAC name is 6-(3,4-dimethoxyphenyl)-4-(3-methoxyphenyl)quinazoline.

Molecular Properties

Compound Name6-(3,4-dimethoxyphenyl)-4-(3-methoxyphenyl)quinazoline
PubChem CID25054919
Molecular FormulaC23H20N2O3
Molecular Weight372.42 g/mol
Exact Mass372.15
IUPAC Name6-(3,4-dimethoxyphenyl)-4-(3-methoxyphenyl)quinazoline
SMILESCOc1cccc(-c2ncnc3ccc(-c4ccc(OC)c(OC)c4)cc23)c1
InChIInChI=1S/C23H20N2O3/c1-26-18-6-4-5-17(11-18)23-19-12-15(7-9-20(19)24-14-25-23)16-8-10-21(27-2)22(13-16)28-3/h4-14H,1-3H3
InChIKeyASLZYEWIGPWAIG-UHFFFAOYSA-N
XLogP4.99
TPSA53.47 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 54.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(3,4-dimethoxyphenyl)-4-(3-methoxyphenyl)quinazoline?
The IUPAC name of 6-(3,4-dimethoxyphenyl)-4-(3-methoxyphenyl)quinazoline (CID 25054919) is 6-(3,4-dimethoxyphenyl)-4-(3-methoxyphenyl)quinazoline.
What is the SMILES notation for 6-(3,4-dimethoxyphenyl)-4-(3-methoxyphenyl)quinazoline?
The canonical SMILES for 6-(3,4-dimethoxyphenyl)-4-(3-methoxyphenyl)quinazoline is COc1cccc(-c2ncnc3ccc(-c4ccc(OC)c(OC)c4)cc23)c1.
What is the InChIKey of 6-(3,4-dimethoxyphenyl)-4-(3-methoxyphenyl)quinazoline?
The InChIKey is ASLZYEWIGPWAIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O3/c1-26-18-6-4-5-17(11-18)23-19-12-15(7-9-20(19)24-14-25-23)16-8-10-21(27-2)22(13-16)28-3/h4-14H,1-3H3.
What are the key properties of 6-(3,4-dimethoxyphenyl)-4-(3-methoxyphenyl)quinazoline?
6-(3,4-dimethoxyphenyl)-4-(3-methoxyphenyl)quinazoline has a molecular weight of 372.42 g/mol, XLogP of 4.99, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,4-dimethoxyphenyl)-4-(3-methoxyphenyl)quinazoline is sourced from PubChem (CID 25054919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).