200,000+ products from a single source!
sales@angenechem.com
Home > Imidazoles > 43069-64-3
43069-64-3 | 5-[(3as,4s,6ar)-5,5-dioxido-2-oxohexahydro-1h-thieno[3,4-d]imidazol-4-yl]pentanoic acid
CAS No: 43069-64-3 Catalog No: AG006ZN7 MDL No:
Product Description
Catalog Number:
AG006ZN7
Chemical Name:
5-[(3as,4s,6ar)-5,5-dioxido-2-oxohexahydro-1h-thieno[3,4-d]imidazol-4-yl]pentanoic acid
CAS Number:
43069-64-3
Molecular Formula:
C10H16N2O5S
Molecular Weight:
276.3094
IUPAC Name:
2-(4-chlorophenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione
InChI:
InChI=1S/C14H12ClNO2/c15-9-5-7-10(8-6-9)16-13(17)11-3-1-2-4-12(11)14(16)18/h1-2,5-8,11-12H,3-4H2
InChI Key:
LVBNTQRVWHUJOP-UHFFFAOYSA-N
SMILES:
OC(=O)CCCC[C@H]1[C@H]2NC(=O)N[C@H]2CS1(=O)=O
Properties
Complexity:
373
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.056g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.705g/mol
Monoisotopic Mass:
261.056g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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.