2-(2-methoxyphenyl)-5-(4-methoxyphenyl)thieno[2,3-d][1,3]oxazin-4-one

C20H15NO4S — CID 1206154

IUPAC2-(2-methoxyphenyl)-5-(4-methoxyphenyl)thieno[2,3-d][1,3]oxazin-4-one
SMILESCOc1ccc(-c2csc3nc(-c4ccccc4OC)oc(=O)c23)cc1
InChIInChI=1S/C20H15NO4S/c1-23-13-9-7-12(8-10-13)15-11-26-19-17(15)20(22)25-18(21-19)14-5-3-4-6-16(14)24-2/h3-11H,1-2H3
InChIKeyJOMVZNNWFRXFAA-UHFFFAOYSA-N
MW365.41 g/mol
LogP4.60
Rot. Bonds4

About 2-(2-methoxyphenyl)-5-(4-methoxyphenyl)thieno[2,3-d][1,3]oxazin-4-one

2-(2-methoxyphenyl)-5-(4-methoxyphenyl)thieno[2,3-d][1,3]oxazin-4-one (PubChem CID 1206154) has the molecular formula C20H15NO4S and a molecular weight of 365.41 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-5-(4-methoxyphenyl)thieno[2,3-d][1,3]oxazin-4-one.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-5-(4-methoxyphenyl)thieno[2,3-d][1,3]oxazin-4-one
PubChem CID1206154
Molecular FormulaC20H15NO4S
Molecular Weight365.41 g/mol
Exact Mass365.07
IUPAC Name2-(2-methoxyphenyl)-5-(4-methoxyphenyl)thieno[2,3-d][1,3]oxazin-4-one
SMILESCOc1ccc(-c2csc3nc(-c4ccccc4OC)oc(=O)c23)cc1
InChIInChI=1S/C20H15NO4S/c1-23-13-9-7-12(8-10-13)15-11-26-19-17(15)20(22)25-18(21-19)14-5-3-4-6-16(14)24-2/h3-11H,1-2H3
InChIKeyJOMVZNNWFRXFAA-UHFFFAOYSA-N
XLogP4.60
TPSA61.56 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.41
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-5-(4-methoxyphenyl)thieno[2,3-d][1,3]oxazin-4-one?
The IUPAC name of 2-(2-methoxyphenyl)-5-(4-methoxyphenyl)thieno[2,3-d][1,3]oxazin-4-one (CID 1206154) is 2-(2-methoxyphenyl)-5-(4-methoxyphenyl)thieno[2,3-d][1,3]oxazin-4-one.
What is the SMILES notation for 2-(2-methoxyphenyl)-5-(4-methoxyphenyl)thieno[2,3-d][1,3]oxazin-4-one?
The canonical SMILES for 2-(2-methoxyphenyl)-5-(4-methoxyphenyl)thieno[2,3-d][1,3]oxazin-4-one is COc1ccc(-c2csc3nc(-c4ccccc4OC)oc(=O)c23)cc1.
What is the InChIKey of 2-(2-methoxyphenyl)-5-(4-methoxyphenyl)thieno[2,3-d][1,3]oxazin-4-one?
The InChIKey is JOMVZNNWFRXFAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15NO4S/c1-23-13-9-7-12(8-10-13)15-11-26-19-17(15)20(22)25-18(21-19)14-5-3-4-6-16(14)24-2/h3-11H,1-2H3.
What are the key properties of 2-(2-methoxyphenyl)-5-(4-methoxyphenyl)thieno[2,3-d][1,3]oxazin-4-one?
2-(2-methoxyphenyl)-5-(4-methoxyphenyl)thieno[2,3-d][1,3]oxazin-4-one has a molecular weight of 365.41 g/mol, XLogP of 4.60, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-5-(4-methoxyphenyl)thieno[2,3-d][1,3]oxazin-4-one is sourced from PubChem (CID 1206154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).