200,000+ products from a single source!
sales@angenechem.com
3364-82-7 | (4-Oxothiazolidin-2-ylidene)acetonitrile
CAS No: 3364-82-7 Catalog No: AG00CZEX MDL No:MFCD02061623
Product Description
Catalog Number:
AG00CZEX
Chemical Name:
(4-Oxothiazolidin-2-ylidene)acetonitrile
CAS Number:
3364-82-7
Molecular Formula:
C5H4N2OS
Molecular Weight:
140.1631
MDL Number:
MFCD02061623
IUPAC Name:
(2Z)-2-(4-oxo-1,3-thiazolidin-2-ylidene)acetonitrile
InChI:
InChI=1S/C5H4N2OS/c6-2-1-5-7-4(8)3-9-5/h1H,3H2,(H,7,8)/b5-1-
InChI Key:
XNPSUGRTBYMMPB-KTAJNNJTSA-N
SMILES:
C1S/C(=C\C#N)/NC1=O
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
140.004g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
140.16g/mol
Monoisotopic Mass:
140.004g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
78.2A^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 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.