4-hydroxy-N,2-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1,1-dioxo-1λ6,2-benzothiazine-3-carboxamide

C15H15N3O5S — CID 54733669

IUPAC4-hydroxy-N,2-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1,1-dioxo-1λ6,2-benzothiazine-3-carboxamide
SMILESCc1cc(N(C)C(=O)C2=C(O)c3ccccc3S(=O)(=O)N2C)no1
InChIInChI=1S/C15H15N3O5S/c1-9-8-12(16-23-9)17(2)15(20)13-14(19)10-6-4-5-7-11(10)24(21,22)18(13)3/h4-8,19H,1-3H3
InChIKeyZVVRDGUMXHPHOI-UHFFFAOYSA-N
MW349.37 g/mol
LogP1.51
Rot. Bonds2

About 4-hydroxy-N,2-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1,1-dioxo-1λ6,2-benzothiazine-3-carboxamide

4-hydroxy-N,2-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1,1-dioxo-1λ6,2-benzothiazine-3-carboxamide (PubChem CID 54733669) has the molecular formula C15H15N3O5S and a molecular weight of 349.37 g/mol. Its IUPAC name is 4-hydroxy-N,2-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1,1-dioxo-1λ6,2-benzothiazine-3-carboxamide.

Molecular Properties

Compound Name4-hydroxy-N,2-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1,1-dioxo-1λ6,2-benzothiazine-3-carboxamide
PubChem CID54733669
Molecular FormulaC15H15N3O5S
Molecular Weight349.37 g/mol
Exact Mass349.07
IUPAC Name4-hydroxy-N,2-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1,1-dioxo-1λ6,2-benzothiazine-3-carboxamide
SMILESCc1cc(N(C)C(=O)C2=C(O)c3ccccc3S(=O)(=O)N2C)no1
InChIInChI=1S/C15H15N3O5S/c1-9-8-12(16-23-9)17(2)15(20)13-14(19)10-6-4-5-7-11(10)24(21,22)18(13)3/h4-8,19H,1-3H3
InChIKeyZVVRDGUMXHPHOI-UHFFFAOYSA-N
XLogP1.51
TPSA103.95 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.37
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N,2-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1,1-dioxo-1λ6,2-benzothiazine-3-carboxamide?
The IUPAC name of 4-hydroxy-N,2-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1,1-dioxo-1λ6,2-benzothiazine-3-carboxamide (CID 54733669) is 4-hydroxy-N,2-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1,1-dioxo-1λ6,2-benzothiazine-3-carboxamide.
What is the SMILES notation for 4-hydroxy-N,2-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1,1-dioxo-1λ6,2-benzothiazine-3-carboxamide?
The canonical SMILES for 4-hydroxy-N,2-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1,1-dioxo-1λ6,2-benzothiazine-3-carboxamide is Cc1cc(N(C)C(=O)C2=C(O)c3ccccc3S(=O)(=O)N2C)no1.
What is the InChIKey of 4-hydroxy-N,2-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1,1-dioxo-1λ6,2-benzothiazine-3-carboxamide?
The InChIKey is ZVVRDGUMXHPHOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O5S/c1-9-8-12(16-23-9)17(2)15(20)13-14(19)10-6-4-5-7-11(10)24(21,22)18(13)3/h4-8,19H,1-3H3.
What are the key properties of 4-hydroxy-N,2-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1,1-dioxo-1λ6,2-benzothiazine-3-carboxamide?
4-hydroxy-N,2-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1,1-dioxo-1λ6,2-benzothiazine-3-carboxamide has a molecular weight of 349.37 g/mol, XLogP of 1.51, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N,2-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1,1-dioxo-1λ6,2-benzothiazine-3-carboxamide is sourced from PubChem (CID 54733669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).