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56196-65-7 | (2Z)-(3-METHYL-4-OXO-1,3-THIAZOLIDIN-2-YLIDENE)ACETONITRILE
CAS No: 56196-65-7 Catalog No: AG00DBF7 MDL No:
Product Description
Catalog Number:
AG00DBF7
Chemical Name:
(2Z)-(3-METHYL-4-OXO-1,3-THIAZOLIDIN-2-YLIDENE)ACETONITRILE
CAS Number:
56196-65-7
IUPAC Name:
(2Z)-2-(3-methyl-4-oxo-1,3-thiazolidin-2-ylidene)acetonitrile
InChI:
InChI=1S/C6H6N2OS/c1-8-5(9)4-10-6(8)2-3-7/h2H,4H2,1H3/b6-2-
InChI Key:
BPCJPESPKLCZSN-KXFIGUGUSA-N
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
154.02g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.187g/mol
Monoisotopic Mass:
154.02g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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