8-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide

C16H12N2O3S — CID 24858338

IUPAC8-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide
SMILESCOc1ccc2c(c1)S(=O)(=O)Nc1c-2ccc2cccnc12
InChIInChI=1S/C16H12N2O3S/c1-21-11-5-7-12-13-6-4-10-3-2-8-17-15(10)16(13)18-22(19,20)14(12)9-11/h2-9,18H,1H3
InChIKeyNREVYNSPZDTOKU-UHFFFAOYSA-N
MW312.35 g/mol
LogP3.02
Rot. Bonds1

About 8-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide

8-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide (PubChem CID 24858338) has the molecular formula C16H12N2O3S and a molecular weight of 312.35 g/mol. Its IUPAC name is 8-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide.

Molecular Properties

Compound Name8-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide
PubChem CID24858338
Molecular FormulaC16H12N2O3S
Molecular Weight312.35 g/mol
Exact Mass312.06
IUPAC Name8-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide
SMILESCOc1ccc2c(c1)S(=O)(=O)Nc1c-2ccc2cccnc12
InChIInChI=1S/C16H12N2O3S/c1-21-11-5-7-12-13-6-4-10-3-2-8-17-15(10)16(13)18-22(19,20)14(12)9-11/h2-9,18H,1H3
InChIKeyNREVYNSPZDTOKU-UHFFFAOYSA-N
XLogP3.02
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.35
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide?
The IUPAC name of 8-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide (CID 24858338) is 8-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide.
What is the SMILES notation for 8-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide?
The canonical SMILES for 8-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide is COc1ccc2c(c1)S(=O)(=O)Nc1c-2ccc2cccnc12.
What is the InChIKey of 8-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide?
The InChIKey is NREVYNSPZDTOKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O3S/c1-21-11-5-7-12-13-6-4-10-3-2-8-17-15(10)16(13)18-22(19,20)14(12)9-11/h2-9,18H,1H3.
What are the key properties of 8-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide?
8-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide has a molecular weight of 312.35 g/mol, XLogP of 3.02, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide is sourced from PubChem (CID 24858338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).