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5624-27-1 | PTH-L-GLUTAMIC ACID
CAS No: 5624-27-1 Catalog No: AG003U0L MDL No:MFCD00070137
Product Description
Catalog Number:
AG003U0L
Chemical Name:
PTH-L-GLUTAMIC ACID
CAS Number:
5624-27-1
MDL Number:
MFCD00070137
IUPAC Name:
3-(5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-yl)propanoic acid
InChI:
InChI=1S/C12H12N2O3S/c15-10(16)7-6-9-11(17)14(12(18)13-9)8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,13,18)(H,15,16)
InChI Key:
ULKNJYDXLYMGFB-UHFFFAOYSA-N
EC Number:
227-056-0
NSC Number:
96413
Properties
Complexity:
366
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.057g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
264.299g/mol
Monoisotopic Mass:
264.057g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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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