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Home Aminos 4-phenyl-N-(propan-2-ylideneamino)-1,3-thiazol-2-amine

4-phenyl-N-(propan-2-ylideneamino)-1,3-thiazol-2-amine

CAS No.:
22067-26-1
Catalog Number:
AG01DKGC
Molecular Formula:
C12H13N3S
Molecular Weight:
231.3167
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Product Description
Catalog Number:
AG01DKGC
Chemical Name:
4-phenyl-N-(propan-2-ylideneamino)-1,3-thiazol-2-amine
CAS Number:
22067-26-1
Molecular Formula:
C12H13N3S
Molecular Weight:
231.3167
MDL Number:
MFCD00564686
IUPAC Name:
4-phenyl-N-(propan-2-ylideneamino)-1,3-thiazol-2-amine
InChI:
InChI=1S/C12H13N3S/c1-9(2)14-15-12-13-11(8-16-12)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,13,15)
InChI Key:
SIGXFKDDWLYFHN-UHFFFAOYSA-N
SMILES:
CC(=NNc1scc(n1)c1ccccc1)C
Properties
Complexity:
245  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.083g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
231.317g/mol
Monoisotopic Mass:
231.083g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
65.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
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