4-methoxy-2-phenyl-1,3-thiazin-6-one

C11H9NO2S — CID 7315325

IUPAC4-methoxy-2-phenyl-1,3-thiazin-6-one
SMILESCOc1cc(=O)sc(-c2ccccc2)n1
InChIInChI=1S/C11H9NO2S/c1-14-9-7-10(13)15-11(12-9)8-5-3-2-4-6-8/h2-7H,1H3
InChIKeyJIPVETKTORCBNQ-UHFFFAOYSA-N
MW219.26 g/mol
LogP2.18
Rot. Bonds2

About 4-methoxy-2-phenyl-1,3-thiazin-6-one

4-methoxy-2-phenyl-1,3-thiazin-6-one (PubChem CID 7315325) has the molecular formula C11H9NO2S and a molecular weight of 219.26 g/mol. Its IUPAC name is 4-methoxy-2-phenyl-1,3-thiazin-6-one.

Molecular Properties

Compound Name4-methoxy-2-phenyl-1,3-thiazin-6-one
PubChem CID7315325
Molecular FormulaC11H9NO2S
Molecular Weight219.26 g/mol
Exact Mass219.04
IUPAC Name4-methoxy-2-phenyl-1,3-thiazin-6-one
SMILESCOc1cc(=O)sc(-c2ccccc2)n1
InChIInChI=1S/C11H9NO2S/c1-14-9-7-10(13)15-11(12-9)8-5-3-2-4-6-8/h2-7H,1H3
InChIKeyJIPVETKTORCBNQ-UHFFFAOYSA-N
XLogP2.18
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.26
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-phenyl-1,3-thiazin-6-one?
The IUPAC name of 4-methoxy-2-phenyl-1,3-thiazin-6-one (CID 7315325) is 4-methoxy-2-phenyl-1,3-thiazin-6-one.
What is the SMILES notation for 4-methoxy-2-phenyl-1,3-thiazin-6-one?
The canonical SMILES for 4-methoxy-2-phenyl-1,3-thiazin-6-one is COc1cc(=O)sc(-c2ccccc2)n1.
What is the InChIKey of 4-methoxy-2-phenyl-1,3-thiazin-6-one?
The InChIKey is JIPVETKTORCBNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9NO2S/c1-14-9-7-10(13)15-11(12-9)8-5-3-2-4-6-8/h2-7H,1H3.
What are the key properties of 4-methoxy-2-phenyl-1,3-thiazin-6-one?
4-methoxy-2-phenyl-1,3-thiazin-6-one has a molecular weight of 219.26 g/mol, XLogP of 2.18, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-phenyl-1,3-thiazin-6-one is sourced from PubChem (CID 7315325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).