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Home Other Building Blocks (5,6-DIHYDRO-4H-[1,3]THIAZIN-2-YL)-(3-TRIFLUOROMETHYL-PHENYL)-AMINE

(5,6-DIHYDRO-4H-[1,3]THIAZIN-2-YL)-(3-TRIFLUOROMETHYL-PHENYL)-AMINE

CAS No.:
102389-25-3
Catalog Number:
AG008TPY
Molecular Formula:
C11H11F3N2S
Molecular Weight:
260.2786
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Product Description
Catalog Number:
AG008TPY
Chemical Name:
(5,6-DIHYDRO-4H-[1,3]THIAZIN-2-YL)-(3-TRIFLUOROMETHYL-PHENYL)-AMINE
CAS Number:
102389-25-3
Molecular Formula:
C11H11F3N2S
Molecular Weight:
260.2786
MDL Number:
MFCD03956544
IUPAC Name:
N-[3-(trifluoromethyl)phenyl]-5,6-dihydro-4H-1,3-thiazin-2-amine
InChI:
InChI=1S/C11H11F3N2S/c12-11(13,14)8-3-1-4-9(7-8)16-10-15-5-2-6-17-10/h1,3-4,7H,2,5-6H2,(H,15,16)
InChI Key:
HTFGSFVRDNBLNS-UHFFFAOYSA-N
SMILES:
FC(c1cccc(c1)NC1=NCCCS1)(F)F
Properties
Complexity:
291  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.06g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
260.278g/mol
Monoisotopic Mass:
260.06g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties