CL-802 - CAS 853695-44-0

Catalog:	BB054806
Product Name:	CL-802
CAS:	853695-44-0
Synonyms:	CL 802; CL802

Technical Data

Computed Properties

IUPAC Name:	2-(3-chloro-4-fluoroanilino)-N-(4-piperidin-1-ylsulfonylphenyl)acetamide
Molecular Weight:	425.90
Molecular Formula:	C19H21ClFN3O3S
Canonical SMILES:	C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CNC3=CC(=C(C=C3)F)Cl
InChI:	InChI=1S/C19H21ClFN3O3S/c20-17-12-15(6-9-18(17)21)22-13-19(25)23-14-4-7-16(8-5-14)28(26,27)24-10-2-1-3-11-24/h4-9,12,22H,1-3,10-11,13H2,(H,23,25)
InChI Key:	VXFKIHSAOLPRJD-UHFFFAOYSA-N
Appearance:	Solid Powder

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Warehouses in multiple cities to ensure fast delivery

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Strict process parameter control to ensure product quality

Large Stock

> 20,000 building blocks and intermediates from stock

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Process scale-up from lab to industrial scale

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Flexible batch size for diverse industrial demands

Related Functional Groups

Amines and Anilines

[1550-50-1]
1,1,2,2-Tetrafluoro-N,N-dimethylethanamine
[1250876-38-0]
1-Cyclopentyl-1H-pyrazole-3,5-diamine
[1431965-90-0]
1-Cyclopentyl-5-methylpyrazol-3-amine hydrochloride
[1431970-24-9]
2,2-Difluoro-N-[1-(1-methylpyrazol-4-yl)ethyl]ethanamine hydrochloride
[328270-02-6]
2-Amino-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
[893444-21-8]
2-Amino-3-nitro-6-(trifluoromethyl)pyridine

Fluorinated Building Blocks

[1946823-77-3]
[1,4-Dimethyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]methanol
[1866059-82-6]
1,1,2,2-Tetrafluoro-3-methylsulfonylpropane
[1011396-69-2]
2,2-Difluoro-N-(4-methoxy-3-(methoxymethyl)benzyl)ethanamine
[35989-28-7]
2,5-Dichloro-4-fluorobenzoic acid
[150517-77-4]
3-Fluoro-5-(trifluoromethyl)benzylamine
[1632145-37-9]
3-Methyl-3-(perfluoropyridin-4-yl)-1,5-dioxaspiro[5.5]undecane-2,4-dione

Piperidines

[1220027-22-4]
4-Methyl-1-(2-Pyrrolidinylmethyl)Piperidine Dihydrochloride
[362489-61-0]
(3S,4R)-1-tert-Butyl 3-methyl 4-aminopiperidine-1,3-dicarboxylate
[821768-09-6]
1-(3-(Trifluoromethyl)pyridin-2-yl)piperidine-4-carboxylic acid
[874800-64-3]
1-(4-Chloro-2-nitrophenyl)piperidine-4-carboxylic acid
[1624301-71-8]
tert-Butyl 3,3-bis(hydroxymethyl)piperidine-1-carboxylate
[2091522-65-3]
tert-butyl 3-cyano-5-hydroxypiperidine-1-carboxylate

Sulfur Compounds

[72799-34-9]
3-(2-Ethoxyphenyl)-2-Thioxoimidazolidin-4-One
[2039-96-5]
3-(Trimethylsilyl)-1-propanesulfonic acid sodium salt
[832739-73-8]
4-(3,5-Dichlorophenyl)pyrimidine-2-thiol
[1879-16-9]
4-Methoxythioanisole
[52147-97-4]
trans-β-Styrenesulfonyl chloride
[1353995-46-6]
(R)-1-((2,4-Dichlorophenyl)sulfonyl)pyrrolidin-3-ol

Complexity:	616
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	425.0976186000001
Formal Charge:	0
Heavy Atom Count:	28
Hydrogen Bond Acceptor Count:	6
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	425.0976186000001
Rotatable Bond Count:	6
Topological Polar Surface Area:	86.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.5