4H-pyrido[3,2-b][1,4]thiazine

C7H6N2S — CID 19746111

IUPAC4H-pyrido[3,2-b][1,4]thiazine
SMILESC1=CSc2cccnc2N1
InChIInChI=1S/C7H6N2S/c1-2-6-7(8-3-1)9-4-5-10-6/h1-5H,(H,8,9)
InChIKeyKYJONJXFUPDUFZ-UHFFFAOYSA-N
MW150.21 g/mol
LogP2.07
Rot. Bonds

About 4H-pyrido[3,2-b][1,4]thiazine

4H-pyrido[3,2-b][1,4]thiazine (PubChem CID 19746111) has the molecular formula C7H6N2S and a molecular weight of 150.21 g/mol. Its IUPAC name is 4H-pyrido[3,2-b][1,4]thiazine.

Molecular Properties

Compound Name4H-pyrido[3,2-b][1,4]thiazine
PubChem CID19746111
Molecular FormulaC7H6N2S
Molecular Weight150.21 g/mol
Exact Mass150.03
IUPAC Name4H-pyrido[3,2-b][1,4]thiazine
SMILESC1=CSc2cccnc2N1
InChIInChI=1S/C7H6N2S/c1-2-6-7(8-3-1)9-4-5-10-6/h1-5H,(H,8,9)
InChIKeyKYJONJXFUPDUFZ-UHFFFAOYSA-N
XLogP2.07
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.21
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4H-pyrido[3,2-b][1,4]thiazine?
The IUPAC name of 4H-pyrido[3,2-b][1,4]thiazine (CID 19746111) is 4H-pyrido[3,2-b][1,4]thiazine.
What is the SMILES notation for 4H-pyrido[3,2-b][1,4]thiazine?
The canonical SMILES for 4H-pyrido[3,2-b][1,4]thiazine is C1=CSc2cccnc2N1.
What is the InChIKey of 4H-pyrido[3,2-b][1,4]thiazine?
The InChIKey is KYJONJXFUPDUFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2S/c1-2-6-7(8-3-1)9-4-5-10-6/h1-5H,(H,8,9).
What are the key properties of 4H-pyrido[3,2-b][1,4]thiazine?
4H-pyrido[3,2-b][1,4]thiazine has a molecular weight of 150.21 g/mol, XLogP of 2.07, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4H-pyrido[3,2-b][1,4]thiazine is sourced from PubChem (CID 19746111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).