2-phenoxy-4H-1,3-thiazine

C10H9NOS — CID 53310447

IUPAC2-phenoxy-4H-1,3-thiazine
SMILESC1=CSC(Oc2ccccc2)=NC1
InChIInChI=1S/C10H9NOS/c1-2-5-9(6-3-1)12-10-11-7-4-8-13-10/h1-6,8H,7H2
InChIKeyVKAZRZWTPYJKJO-UHFFFAOYSA-N
MW191.26 g/mol
LogP2.68
Rot. Bonds1

About 2-phenoxy-4H-1,3-thiazine

2-phenoxy-4H-1,3-thiazine (PubChem CID 53310447) has the molecular formula C10H9NOS and a molecular weight of 191.26 g/mol. Its IUPAC name is 2-phenoxy-4H-1,3-thiazine.

Molecular Properties

Compound Name2-phenoxy-4H-1,3-thiazine
PubChem CID53310447
Molecular FormulaC10H9NOS
Molecular Weight191.26 g/mol
Exact Mass191.04
IUPAC Name2-phenoxy-4H-1,3-thiazine
SMILESC1=CSC(Oc2ccccc2)=NC1
InChIInChI=1S/C10H9NOS/c1-2-5-9(6-3-1)12-10-11-7-4-8-13-10/h1-6,8H,7H2
InChIKeyVKAZRZWTPYJKJO-UHFFFAOYSA-N
XLogP2.68
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.26
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-phenoxy-4H-1,3-thiazine?
The IUPAC name of 2-phenoxy-4H-1,3-thiazine (CID 53310447) is 2-phenoxy-4H-1,3-thiazine.
What is the SMILES notation for 2-phenoxy-4H-1,3-thiazine?
The canonical SMILES for 2-phenoxy-4H-1,3-thiazine is C1=CSC(Oc2ccccc2)=NC1.
What is the InChIKey of 2-phenoxy-4H-1,3-thiazine?
The InChIKey is VKAZRZWTPYJKJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NOS/c1-2-5-9(6-3-1)12-10-11-7-4-8-13-10/h1-6,8H,7H2.
What are the key properties of 2-phenoxy-4H-1,3-thiazine?
2-phenoxy-4H-1,3-thiazine has a molecular weight of 191.26 g/mol, XLogP of 2.68, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-4H-1,3-thiazine is sourced from PubChem (CID 53310447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).