200,000+ products from a single source!
sales@angenechem.com
18623-60-4 | 4-(4-OXO-2-THIOXO-THIAZOLIDIN-3-YL)-BUTYRIC ACID
CAS No: 18623-60-4 Catalog No: AG00APRN MDL No:MFCD00457540
Product Description
Catalog Number:
AG00APRN
Chemical Name:
4-(4-OXO-2-THIOXO-THIAZOLIDIN-3-YL)-BUTYRIC ACID
CAS Number:
18623-60-4
Molecular Formula:
C7H9NO3S2
Molecular Weight:
219.2813
MDL Number:
MFCD00457540
IUPAC Name:
4-(4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)butanoic acid
InChI:
InChI=1S/C7H9NO3S2/c9-5-4-13-7(12)8(5)3-1-2-6(10)11/h1-4H2,(H,10,11)
InChI Key:
KCDHBLVYRSYUBV-UHFFFAOYSA-N
SMILES:
OC(=O)CCCN1C(=S)SCC1=O
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.002g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
219.273g/mol
Monoisotopic Mass:
219.002g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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.