1H-pyrido[4,3-c]thiazine

C7H6N2S — CID 45079588

IUPAC1H-pyrido[4,3-c]thiazine
SMILESC1=Cc2cnccc2NS1
InChIInChI=1S/C7H6N2S/c1-3-8-5-6-2-4-10-9-7(1)6/h1-5,9H
InChIKeyAXQQVYHZHBOKEZ-UHFFFAOYSA-N
MW150.21 g/mol
LogP2.13
Rot. Bonds

About 1H-pyrido[4,3-c]thiazine

1H-pyrido[4,3-c]thiazine (PubChem CID 45079588) has the molecular formula C7H6N2S and a molecular weight of 150.21 g/mol. Its IUPAC name is 1H-pyrido[4,3-c]thiazine.

Molecular Properties

Compound Name1H-pyrido[4,3-c]thiazine
PubChem CID45079588
Molecular FormulaC7H6N2S
Molecular Weight150.21 g/mol
Exact Mass150.03
IUPAC Name1H-pyrido[4,3-c]thiazine
SMILESC1=Cc2cnccc2NS1
InChIInChI=1S/C7H6N2S/c1-3-8-5-6-2-4-10-9-7(1)6/h1-5,9H
InChIKeyAXQQVYHZHBOKEZ-UHFFFAOYSA-N
XLogP2.13
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 ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'sulphur_nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1H-pyrido[4,3-c]thiazine?
The IUPAC name of 1H-pyrido[4,3-c]thiazine (CID 45079588) is 1H-pyrido[4,3-c]thiazine.
What is the SMILES notation for 1H-pyrido[4,3-c]thiazine?
The canonical SMILES for 1H-pyrido[4,3-c]thiazine is C1=Cc2cnccc2NS1.
What is the InChIKey of 1H-pyrido[4,3-c]thiazine?
The InChIKey is AXQQVYHZHBOKEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2S/c1-3-8-5-6-2-4-10-9-7(1)6/h1-5,9H.
What are the key properties of 1H-pyrido[4,3-c]thiazine?
1H-pyrido[4,3-c]thiazine has a molecular weight of 150.21 g/mol, XLogP of 2.13, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-pyrido[4,3-c]thiazine is sourced from PubChem (CID 45079588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).