12H-quinolino[3,4-b][1,4]benzothiazine

C15H10N2S — CID 11242149

IUPAC12H-quinolino[3,4-b][1,4]benzothiazine
SMILESc1ccc2c(c1)Nc1c(cnc3ccccc13)S2
InChIInChI=1S/C15H10N2S/c1-2-6-11-10(5-1)15-14(9-16-11)18-13-8-4-3-7-12(13)17-15/h1-9,17H
InChIKeyPCJUZVZEBDPWTK-UHFFFAOYSA-N
MW250.33 g/mol
LogP4.44
Rot. Bonds

About 12H-quinolino[3,4-b][1,4]benzothiazine

12H-quinolino[3,4-b][1,4]benzothiazine (PubChem CID 11242149) has the molecular formula C15H10N2S and a molecular weight of 250.33 g/mol. Its IUPAC name is 12H-quinolino[3,4-b][1,4]benzothiazine.

Molecular Properties

Compound Name12H-quinolino[3,4-b][1,4]benzothiazine
PubChem CID11242149
Molecular FormulaC15H10N2S
Molecular Weight250.33 g/mol
Exact Mass250.06
IUPAC Name12H-quinolino[3,4-b][1,4]benzothiazine
SMILESc1ccc2c(c1)Nc1c(cnc3ccccc13)S2
InChIInChI=1S/C15H10N2S/c1-2-6-11-10(5-1)15-14(9-16-11)18-13-8-4-3-7-12(13)17-15/h1-9,17H
InChIKeyPCJUZVZEBDPWTK-UHFFFAOYSA-N
XLogP4.44
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.33
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 12H-quinolino[3,4-b][1,4]benzothiazine?
The IUPAC name of 12H-quinolino[3,4-b][1,4]benzothiazine (CID 11242149) is 12H-quinolino[3,4-b][1,4]benzothiazine.
What is the SMILES notation for 12H-quinolino[3,4-b][1,4]benzothiazine?
The canonical SMILES for 12H-quinolino[3,4-b][1,4]benzothiazine is c1ccc2c(c1)Nc1c(cnc3ccccc13)S2.
What is the InChIKey of 12H-quinolino[3,4-b][1,4]benzothiazine?
The InChIKey is PCJUZVZEBDPWTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2S/c1-2-6-11-10(5-1)15-14(9-16-11)18-13-8-4-3-7-12(13)17-15/h1-9,17H.
What are the key properties of 12H-quinolino[3,4-b][1,4]benzothiazine?
12H-quinolino[3,4-b][1,4]benzothiazine has a molecular weight of 250.33 g/mol, XLogP of 4.44, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 12H-quinolino[3,4-b][1,4]benzothiazine is sourced from PubChem (CID 11242149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).