Grapiprant Impurity 2

CAT: 1299-RM-G180102-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-G180102-01Size:10 mg

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CAS Number

5219-81-8

Synonyms

N, N'-carbonylbis (4-methylbenzenesulfonamide)

Molecular Formula

C15H16N2O5S2

Molecular Weight

368.42

Target Alternative Name

Grapiprant

Product Name Synonym

N, N'-carbonylbis (4-methylbenzenesulfonamide)

Chemical Information

Benzenesulfonamide, N,N'-carbonylbis[4-methyl-

CAS Number	5219-81-8
PubChem CID	12244426
IUPAC Name	1,3-bis-(4-methylphenyl)sulfonylurea
Molecular Formula	C15H16N2O5S2
Molecular Weight	368.4
XLogP	2.4
Topological Polar Surface Area	126
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Heavy Atom Count	24
Formal Charge	0
Complexity	576

SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C15H16N2O5S2/c1-11-3-7-13(8-4-11)23(19,20)16-15(18)17-24(21,22)14-9-5-12(2)6-10-14/h3-10H,1-2H3,(H2,16,17,18)

InChIKey

YBLWHGQKHHKWRU-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 5219-81-8

CID: 12244426

Formula: C15H16N2O5S2

MW: 368.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	368.4
XLogP3	2.4
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	4
Exact Mass	368.05006396
Monoisotopic Mass	368.05006396
Topological Polar Surface Area	126 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	576
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

Catalog	Name
RM-G180103-01	Grapiprant Impurity 3
RM-G180104-01	Grapiprant Impurity 4
RM-G180101-01	Grapiprant Impurity 1
RM-G180100-01	Grapiprant
RM-G271002-01	Gc376 Impurity 2; Nirmatrelvir Impurity
RM-S060226-01	Sofosbuvir Impurity 2; Sofosbuvir Impurity V
RM-V192041-01	Valsartan Impurity 41; Sacubitril Impurity 2
RM-V192107-01	Valsartan Impurity 107; Amlodipine Impurity 2
RM-K200339-01	Ketoconazole Impurity 39; Itraconazole Impurity 2
RM-I231002-01	Ivacaftor Impurity 2

Catalog	Name
AR-G02881-01	Grapiprant Impurity 1
AR-G02887-01	Grapiprant Carbamic Acid Impurity
AR-G02883-01	Grapiprant Impurity 1 3HCl Salt
GTR19164466-01	Grapiprant
HY-16781R-01	Grapiprant (Standard)
CS-O-48489	Grapiprant D5
MBS3841287-01	Grapiprant (CJ-023423)
A15964-100	Grapiprant (CJ-023423) 100mg
C12131-01	Grapiprant (CJ-023,423)
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