KN-93 Phosphate 10mg

CAT: 0628-A14288-10Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0628-A14288-10Size:10 mg

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CAS Number

1188890-41-6

Chemical Information

KN-93 Phosphate

CAS Number	1188890-41-6
PubChem CID	16760530
IUPAC Name	N-[2-[[[(E)-3-(4-chlorophenyl)prop-2-enyl]-methylamino]methyl]phenyl]-N-(2-hydroxyethyl)-4-methoxybenzenesulfonamide;phosphoric acid
Molecular Formula	C26H32ClN2O8PS
Molecular Weight	599.0
Topological Polar Surface Area	156
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	11
Heavy Atom Count	39
Formal Charge	0
Complexity	763

SMILES

CN(C/C=C/C1=CC=C(C=C1)Cl)CC2=CC=CC=C2N(CCO)S(=O)(=O)C3=CC=C(C=C3)OC.OP(=O)(O)O

InChI

InChI=1S/C26H29ClN2O4S.H3O4P/c1-28(17-5-6-21-9-11-23(27)12-10-21)20-22-7-3-4-8-26(22)29(18-19-30)34(31,32)25-15-13-24(33-2)14-16-25;1-5(2,3)4/h3-16,30H,17-20H2,1-2H3;(H3,1,2,3,4)/b6-5+;

InChIKey

NNKJTPOXLIILMB-IPZCTEOASA-N

Chemical Structure

2D Structure

CAS: 1188890-41-6

CID: 16760530

Formula: C26H32ClN2O8PS

MW: 599.0

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	599.0
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	11
Exact Mass	598.1305518
Monoisotopic Mass	598.1305518
Topological Polar Surface Area	156 Å²
Heavy Atom Count	39
Formal Charge	0
Complexity	763
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

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A22229-5	KN-93 phosphate 5mg
A14288-50	KN-93 Phosphate 50mg
A14288-25	KN-93 Phosphate 25mg
A14288-5	KN-93 Phosphate 5mg
A22229-25	KN-93 phosphate 25mg
A22229-100	KN-93 phosphate 100mg
A22229-50	KN-93 phosphate 50mg

Alternative Products

Catalog	Name
B4969-25	KN-93 Phosphate
255605	KN 93 phosphate
HY-15465B-01	KN-93 (phosphate)

KN-93 Phosphate 10mg

Chemical Information

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