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

C16H12N2O2S — CID 16759925

IUPAC9-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide
SMILESCc1ccc2c(c1)-c1ccc3cccnc3c1NS2(=O)=O
InChIInChI=1S/C16H12N2O2S/c1-10-4-7-14-13(9-10)12-6-5-11-3-2-8-17-15(11)16(12)18-21(14,19)20/h2-9,18H,1H3
InChIKeyKYPLTYNYSYVGGA-UHFFFAOYSA-N
MW296.35 g/mol
LogP3.32
Rot. Bonds

About 9-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide

9-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide (PubChem CID 16759925) has the molecular formula C16H12N2O2S and a molecular weight of 296.35 g/mol. Its IUPAC name is 9-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide.

Molecular Properties

Compound Name9-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide
PubChem CID16759925
Molecular FormulaC16H12N2O2S
Molecular Weight296.35 g/mol
Exact Mass296.06
IUPAC Name9-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide
SMILESCc1ccc2c(c1)-c1ccc3cccnc3c1NS2(=O)=O
InChIInChI=1S/C16H12N2O2S/c1-10-4-7-14-13(9-10)12-6-5-11-3-2-8-17-15(11)16(12)18-21(14,19)20/h2-9,18H,1H3
InChIKeyKYPLTYNYSYVGGA-UHFFFAOYSA-N
XLogP3.32
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.35
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide?
The IUPAC name of 9-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide (CID 16759925) is 9-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide.
What is the SMILES notation for 9-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide?
The canonical SMILES for 9-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide is Cc1ccc2c(c1)-c1ccc3cccnc3c1NS2(=O)=O.
What is the InChIKey of 9-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide?
The InChIKey is KYPLTYNYSYVGGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O2S/c1-10-4-7-14-13(9-10)12-6-5-11-3-2-8-17-15(11)16(12)18-21(14,19)20/h2-9,18H,1H3.
What are the key properties of 9-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide?
9-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide has a molecular weight of 296.35 g/mol, XLogP of 3.32, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide is sourced from PubChem (CID 16759925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).