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863763-64-8 | 3-cyclopropyl-2-phenyl-1,3-thiazolidin-4-one
CAS No: 863763-64-8 Catalog No: AG019OKA MDL No:MFCD07339243
Product Description
Catalog Number:
AG019OKA
Chemical Name:
3-cyclopropyl-2-phenyl-1,3-thiazolidin-4-one
CAS Number:
863763-64-8
Molecular Formula:
C12H13NOS
Molecular Weight:
219.3027
MDL Number:
MFCD07339243
IUPAC Name:
3-cyclopropyl-2-phenyl-1,3-thiazolidin-4-one
InChI:
InChI=1S/C12H13NOS/c14-11-8-15-12(13(11)10-6-7-10)9-4-2-1-3-5-9/h1-5,10,12H,6-8H2
InChI Key:
CAQHDFBDKHDMKL-UHFFFAOYSA-N
SMILES:
O=C1CSC(N1C1CC1)c1ccccc1
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.072g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.302g/mol
Monoisotopic Mass:
219.072g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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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