Lornoxicam Impurity 28

CAT: 1299-RM-L151428-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-L151428-01Size:10 mg

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CAS Number

123252-96-0

Synonyms

6-chloro-4-hydroxy-N- (5-hydroxypyridin-2-yl) -2-methyl-2H-thieno[2,3-e][1,2]thiazine-3-carboxamide 1,1-dioxide

Molecular Formula

C13H10ClN3O5S2

Molecular Weight

387.82

Target Alternative Name

Lornoxicam

Product Name Synonym

6-chloro-4-hydroxy-N- (5-hydroxypyridin-2-yl) -2-methyl-2H-thieno[2,3-e][1,2]thiazine-3-carboxamide 1,1-dioxide

Chemical Information

2H-Thieno(2,3-e)-1,2-thiazine-3-carboxamide, 6-chloro-4-hydroxy-N-(5-hydroxy-2-pyridinyl)-2-methyl-, 1,1-dioxide

CAS Number	123252-96-0
PubChem CID	54691489
IUPAC Name	6-chloro-4-hydroxy-N-(5-hydroxy-2-pyridinyl)-2-methyl-1,1-dioxothieno[2,3-e]thiazine-3-carboxamide
Molecular Formula	C13H10ClN3O5S2
Molecular Weight	387.8
XLogP	1.8
Topological Polar Surface Area	156
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	2
Heavy Atom Count	24
Formal Charge	0
Complexity	665

SMILES

CN1C(=C(C2=C(S1(=O)=O)C=C(S2)Cl)O)C(=O)NC3=NC=C(C=C3)O

InChI

InChI=1S/C13H10ClN3O5S2/c1-17-10(13(20)16-9-3-2-6(18)5-15-9)11(19)12-7(24(17,21)22)4-8(14)23-12/h2-5,18-19H,1H3,(H,15,16,20)

InChIKey

NQOMZUZLRFQVLR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 123252-96-0

CID: 54691489

Formula: C13H10ClN3O5S2

MW: 387.8

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	387.8
XLogP3	1.8
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	2
Exact Mass	386.9750405
Monoisotopic Mass	386.9750405
Topological Polar Surface Area	156 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	665
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes