Name: Name:2-(2-amino-1,3-thiazol-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol
Brand: Angene
SKU: AG019H2D
Rating: 90 (10 reviews)

2-(2-amino-1,3-thiazol-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol

CAS No.:

306956-12-7

Catalog Number:

AG019H2D

Molecular Formula:

C6H4F6N2OS

Molecular Weight:

266.1642

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Product Description

Catalog Number:

AG019H2D

Chemical Name:

2-(2-amino-1,3-thiazol-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol

CAS Number:

306956-12-7

Molecular Formula:

C6H4F6N2OS

Molecular Weight:

266.1642

MDL Number:

MFCD02704596

IUPAC Name:

2-(2-amino-1,3-thiazol-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol

InChI:

InChI=1S/C6H4F6N2OS/c7-5(8,9)4(15,6(10,11)12)2-1-14-3(13)16-2/h1,15H,(H2,13,14)

InChI Key:

UMAOHXPHVQUDRE-UHFFFAOYSA-N

SMILES:

OC(C(F)(F)F)(C(F)(F)F)c1cnc(s1)N

Properties

Complexity:

253

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

265.995g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

266.161g/mol

Monoisotopic Mass:

265.995g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

87.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101