2-methoxy-[1,3]thiazolo[2,3-b]quinazolin-5-one

C11H8N2O2S — CID 19826341

IUPAC2-methoxy-[1,3]thiazolo[2,3-b]quinazolin-5-one
SMILESCOc1cn2c(=O)c3ccccc3nc2s1
InChIInChI=1S/C11H8N2O2S/c1-15-9-6-13-10(14)7-4-2-3-5-8(7)12-11(13)16-9/h2-6H,1H3
InChIKeyRYVNJAUSTLOFBR-UHFFFAOYSA-N
MW232.26 g/mol
LogP1.92
Rot. Bonds1

About 2-methoxy-[1,3]thiazolo[2,3-b]quinazolin-5-one

2-methoxy-[1,3]thiazolo[2,3-b]quinazolin-5-one (PubChem CID 19826341) has the molecular formula C11H8N2O2S and a molecular weight of 232.26 g/mol. Its IUPAC name is 2-methoxy-[1,3]thiazolo[2,3-b]quinazolin-5-one.

Molecular Properties

Compound Name2-methoxy-[1,3]thiazolo[2,3-b]quinazolin-5-one
PubChem CID19826341
Molecular FormulaC11H8N2O2S
Molecular Weight232.26 g/mol
Exact Mass232.03
IUPAC Name2-methoxy-[1,3]thiazolo[2,3-b]quinazolin-5-one
SMILESCOc1cn2c(=O)c3ccccc3nc2s1
InChIInChI=1S/C11H8N2O2S/c1-15-9-6-13-10(14)7-4-2-3-5-8(7)12-11(13)16-9/h2-6H,1H3
InChIKeyRYVNJAUSTLOFBR-UHFFFAOYSA-N
XLogP1.92
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.26
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-[1,3]thiazolo[2,3-b]quinazolin-5-one?
The IUPAC name of 2-methoxy-[1,3]thiazolo[2,3-b]quinazolin-5-one (CID 19826341) is 2-methoxy-[1,3]thiazolo[2,3-b]quinazolin-5-one.
What is the SMILES notation for 2-methoxy-[1,3]thiazolo[2,3-b]quinazolin-5-one?
The canonical SMILES for 2-methoxy-[1,3]thiazolo[2,3-b]quinazolin-5-one is COc1cn2c(=O)c3ccccc3nc2s1.
What is the InChIKey of 2-methoxy-[1,3]thiazolo[2,3-b]quinazolin-5-one?
The InChIKey is RYVNJAUSTLOFBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N2O2S/c1-15-9-6-13-10(14)7-4-2-3-5-8(7)12-11(13)16-9/h2-6H,1H3.
What are the key properties of 2-methoxy-[1,3]thiazolo[2,3-b]quinazolin-5-one?
2-methoxy-[1,3]thiazolo[2,3-b]quinazolin-5-one has a molecular weight of 232.26 g/mol, XLogP of 1.92, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-[1,3]thiazolo[2,3-b]quinazolin-5-one is sourced from PubChem (CID 19826341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).