N-(4-oxo-1,3-benzothiazin-2-yl)benzamide

C15H10N2O2S — CID 658982

IUPACN-(4-oxo-1,3-benzothiazin-2-yl)benzamide
SMILESO=C(Nc1nc(=O)c2ccccc2s1)c1ccccc1
InChIInChI=1S/C15H10N2O2S/c18-13(10-6-2-1-3-7-10)16-15-17-14(19)11-8-4-5-9-12(11)20-15/h1-9H,(H,16,17,18,19)
InChIKeyQUQMZOJJCAYNOI-UHFFFAOYSA-N
MW282.32 g/mol
LogP2.91
Rot. Bonds2

About N-(4-oxo-1,3-benzothiazin-2-yl)benzamide

N-(4-oxo-1,3-benzothiazin-2-yl)benzamide (PubChem CID 658982) has the molecular formula C15H10N2O2S and a molecular weight of 282.32 g/mol. Its IUPAC name is N-(4-oxo-1,3-benzothiazin-2-yl)benzamide.

Molecular Properties

Compound NameN-(4-oxo-1,3-benzothiazin-2-yl)benzamide
PubChem CID658982
Molecular FormulaC15H10N2O2S
Molecular Weight282.32 g/mol
Exact Mass282.05
IUPAC NameN-(4-oxo-1,3-benzothiazin-2-yl)benzamide
SMILESO=C(Nc1nc(=O)c2ccccc2s1)c1ccccc1
InChIInChI=1S/C15H10N2O2S/c18-13(10-6-2-1-3-7-10)16-15-17-14(19)11-8-4-5-9-12(11)20-15/h1-9H,(H,16,17,18,19)
InChIKeyQUQMZOJJCAYNOI-UHFFFAOYSA-N
XLogP2.91
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.32
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-oxo-1,3-benzothiazin-2-yl)benzamide?
The IUPAC name of N-(4-oxo-1,3-benzothiazin-2-yl)benzamide (CID 658982) is N-(4-oxo-1,3-benzothiazin-2-yl)benzamide.
What is the SMILES notation for N-(4-oxo-1,3-benzothiazin-2-yl)benzamide?
The canonical SMILES for N-(4-oxo-1,3-benzothiazin-2-yl)benzamide is O=C(Nc1nc(=O)c2ccccc2s1)c1ccccc1.
What is the InChIKey of N-(4-oxo-1,3-benzothiazin-2-yl)benzamide?
The InChIKey is QUQMZOJJCAYNOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2O2S/c18-13(10-6-2-1-3-7-10)16-15-17-14(19)11-8-4-5-9-12(11)20-15/h1-9H,(H,16,17,18,19).
What are the key properties of N-(4-oxo-1,3-benzothiazin-2-yl)benzamide?
N-(4-oxo-1,3-benzothiazin-2-yl)benzamide has a molecular weight of 282.32 g/mol, XLogP of 2.91, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-oxo-1,3-benzothiazin-2-yl)benzamide is sourced from PubChem (CID 658982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).