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Home > Imidazoles > 83253-38-7
83253-38-7 | 6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazole-5-carbonitrile
CAS No: 83253-38-7 Catalog No: AG01CB1Z MDL No:MFCD00268963
Product Description
Catalog Number:
AG01CB1Z
Chemical Name:
6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazole-5-carbonitrile
CAS Number:
83253-38-7
Molecular Formula:
C12H9N3S
Molecular Weight:
227.2850
MDL Number:
MFCD00268963
IUPAC Name:
6-phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazole-5-carbonitrile
InChI:
InChI=1S/C12H9N3S/c13-8-10-11(9-4-2-1-3-5-9)14-12-15(10)6-7-16-12/h1-5H,6-7H2
InChI Key:
IZQIKDXGZAUCPH-UHFFFAOYSA-N
SMILES:
N#Cc1c(nc2n1CCS2)c1ccccc1
NSC Number:
332754
Properties
Complexity:
305
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.052g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.285g/mol
Monoisotopic Mass:
227.052g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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 |
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