3-oxo-N-phenyl-4H-1,4-benzothiazine-6-carboxamide

C15H12N2O2S — CID 24643274

IUPAC3-oxo-N-phenyl-4H-1,4-benzothiazine-6-carboxamide
SMILESO=C1CSc2ccc(C(=O)Nc3ccccc3)cc2N1
InChIInChI=1S/C15H12N2O2S/c18-14-9-20-13-7-6-10(8-12(13)17-14)15(19)16-11-4-2-1-3-5-11/h1-8H,9H2,(H,16,19)(H,17,18)
InChIKeyRSIINVWMUAWMMV-UHFFFAOYSA-N
MW284.34 g/mol
LogP2.98
Rot. Bonds2

About 3-oxo-N-phenyl-4H-1,4-benzothiazine-6-carboxamide

3-oxo-N-phenyl-4H-1,4-benzothiazine-6-carboxamide (PubChem CID 24643274) has the molecular formula C15H12N2O2S and a molecular weight of 284.34 g/mol. Its IUPAC name is 3-oxo-N-phenyl-4H-1,4-benzothiazine-6-carboxamide.

Molecular Properties

Compound Name3-oxo-N-phenyl-4H-1,4-benzothiazine-6-carboxamide
PubChem CID24643274
Molecular FormulaC15H12N2O2S
Molecular Weight284.34 g/mol
Exact Mass284.06
IUPAC Name3-oxo-N-phenyl-4H-1,4-benzothiazine-6-carboxamide
SMILESO=C1CSc2ccc(C(=O)Nc3ccccc3)cc2N1
InChIInChI=1S/C15H12N2O2S/c18-14-9-20-13-7-6-10(8-12(13)17-14)15(19)16-11-4-2-1-3-5-11/h1-8H,9H2,(H,16,19)(H,17,18)
InChIKeyRSIINVWMUAWMMV-UHFFFAOYSA-N
XLogP2.98
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.34
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-oxo-N-(3-phenoxyphenyl)-4H-1,4-benzothiazine-6-carboxamide
CID 55344492
3-oxo-N-pyridin-3-yl-4H-1,4-benzothiazine-6-carboxamide
CID 26592395
N-[4-(ethylcarbamoyl)phenyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
CID 55753946
1-(3-oxo-4H-1,4-benzothiazin-6-yl)-3-phenylurea
CID 31772262
6-benzoyl-4H-1,4-benzothiazin-3-one
CID 11958353
N-[4-(2-methoxyphenoxy)phenyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
CID 42009236
3-oxo-N-[3-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]-4H-1,4-benzothiazine-6-carboxamide
CID 26289464
N-[4-(4-methylphenoxy)phenyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
CID 7980632
N-(3-oxo-4H-1,4-benzothiazin-6-yl)-3-phenoxybenzamide
CID 35875024
3-oxo-N-(5-phenyl-1,3,4-thiadiazol-2-yl)-4H-1,4-benzothiazine-6-carboxamide
CID 35565242
2-(3-oxo-4H-1,4-benzothiazin-6-yl)-N-phenylacetamide
CID 110771518
N-(4-morpholin-4-ylphenyl)-3-oxo-4H-1,4-benzothiazine-6-carboxamide
CID 7922294

Frequently Asked Questions

What is the IUPAC name of 3-oxo-N-phenyl-4H-1,4-benzothiazine-6-carboxamide?
The IUPAC name of 3-oxo-N-phenyl-4H-1,4-benzothiazine-6-carboxamide (CID 24643274) is 3-oxo-N-phenyl-4H-1,4-benzothiazine-6-carboxamide.
What is the SMILES notation for 3-oxo-N-phenyl-4H-1,4-benzothiazine-6-carboxamide?
The canonical SMILES for 3-oxo-N-phenyl-4H-1,4-benzothiazine-6-carboxamide is O=C1CSc2ccc(C(=O)Nc3ccccc3)cc2N1.
What is the InChIKey of 3-oxo-N-phenyl-4H-1,4-benzothiazine-6-carboxamide?
The InChIKey is RSIINVWMUAWMMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2S/c18-14-9-20-13-7-6-10(8-12(13)17-14)15(19)16-11-4-2-1-3-5-11/h1-8H,9H2,(H,16,19)(H,17,18).
What are the key properties of 3-oxo-N-phenyl-4H-1,4-benzothiazine-6-carboxamide?
3-oxo-N-phenyl-4H-1,4-benzothiazine-6-carboxamide has a molecular weight of 284.34 g/mol, XLogP of 2.98, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-oxo-N-phenyl-4H-1,4-benzothiazine-6-carboxamide is sourced from PubChem (CID 24643274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).