Lornoxicam Impurity 21

CAT: 1299-RM-L151421-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-L151421-01Size:10 mg

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CAS Number

1333316-60-1

Synonyms

6-chloro-2-methyl-2H-thieno[2,3-e][1,2]thiazin-4 (3H) -one 1,1-dioxide

Molecular Formula

C7H6ClNO3S2

Molecular Weight

251.71

Target Alternative Name

Lornoxicam

Product Name Synonym

6-chloro-2-methyl-2H-thieno[2,3-e][1,2]thiazin-4 (3H) -one 1,1-dioxide

Chemical Information

6-chloro-2-methyl-1,1-dioxo-3H-thieno[2,3-e]thiazin-4-one

CAS Number	1333316-60-1
PubChem CID	176483931
IUPAC Name	6-chloro-2-methyl-1,1-dioxo-3H-thieno[2,3-e]thiazin-4-one
Molecular Formula	C7H6ClNO3S2
Molecular Weight	251.7
XLogP	1.6
Topological Polar Surface Area	91.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	0
Heavy Atom Count	14
Formal Charge	0
Complexity	364

SMILES

CN1CC(=O)C2=C(S1(=O)=O)C=C(S2)Cl

InChI

InChI=1S/C7H6ClNO3S2/c1-9-3-4(10)7-5(14(9,11)12)2-6(8)13-7/h2H,3H2,1H3

InChIKey

JUMLCYOFWCGNMU-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1333316-60-1

CID: 176483931

Formula: C7H6ClNO3S2

MW: 251.7

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	251.7
XLogP3	1.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	0
Exact Mass	250.9477631
Monoisotopic Mass	250.9477631
Topological Polar Surface Area	91.1 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	364
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