Lornoxicam-d4

CAT: 0024-sc-280930Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-280930Size:5 mg

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CAS Number

1216527-48-8

Chemical Information

Lornoxicam-d4

CAS Number	1216527-48-8
PubChem CID	71749841
IUPAC Name	6-chloro-4-hydroxy-2-methyl-1,1-dioxo-N-(3,4,5,6-tetradeuterio-2-pyridinyl)thieno[2,3-e]thiazine-3-carboxamide
Molecular Formula	C13H10ClN3O4S2
Molecular Weight	375.8
XLogP	2.1
Topological Polar Surface Area	136
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	2
Heavy Atom Count	23
Formal Charge	0
Complexity	634

SMILES

[2H]C1=C(C(=NC(=C1[2H])NC(=O)C2=C(C3=C(C=C(S3)Cl)S(=O)(=O)N2C)O)[2H])[2H]

InChI

InChI=1S/C13H10ClN3O4S2/c1-17-10(13(19)16-9-4-2-3-5-15-9)11(18)12-7(23(17,20)21)6-8(14)22-12/h2-6,18H,1H3,(H,15,16,19)/i2D,3D,4D,5D

InChIKey

WLHQHAUOOXYABV-QFFDRWTDSA-N

Chemical Structure

2D Structure

CAS: 1216527-48-8

CID: 71749841

Formula: C13H10ClN3O4S2

MW: 375.8

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	375.8
XLogP3	2.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	2
Exact Mass	375.0052328
Monoisotopic Mass	375.0052328
Topological Polar Surface Area	136 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	634
Isotope Atom Count	4
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

Catalog	Name
sc-207833	Lornoxicam
sc-207833A	Lornoxicam
sc-491441	Lornoxicam-d3
sc-210330	5-Hydroxy Lornoxicam
sc-300814	Hydroquinone-d4 (ring-d4)
sc-506150	Triclocarban-d4 (4-chlorophenyl-d4)
sc-280875	Keto Pioglitazone-d4 (M-III-d4)
sc-477791A	β-NADH-d4 (d4 major) Diammonium Salt
sc-477791	β-NADH-d4 (d4 major) Diammonium Salt
sc-219955	Rebamipide-d4

Catalog	Name
T71212-01	Lornoxicam-d4
FL24940-01	Lornoxicam