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Home > Indoles and Oxindole > 79962-56-4
79962-56-4 | Spiro[3H-indole-3,2'-thiazolidine]-2,4'(1H)-dione, 3'-phenyl-
CAS No: 79962-56-4 Catalog No: AG004Z1T MDL No:MFCD00140907
Product Description
Catalog Number:
AG004Z1T
Chemical Name:
Spiro[3H-indole-3,2'-thiazolidine]-2,4'(1H)-dione, 3'-phenyl-
CAS Number:
79962-56-4
Molecular Formula:
C16H12N2O2S
Molecular Weight:
296.3437
MDL Number:
MFCD00140907
IUPAC Name:
3-phenylspiro[1,3-thiazolidine-2,3'-1H-indole]-2',4-dione
InChI:
InChI=1S/C16H12N2O2S/c19-14-10-21-16(18(14)11-6-2-1-3-7-11)12-8-4-5-9-13(12)17-15(16)20/h1-9H,10H2,(H,17,20)
InChI Key:
YOUZPGWSTPAIRL-UHFFFAOYSA-N
SMILES:
O=C1CSC2(N1c1ccccc1)C(=O)Nc1c2cccc1
Properties
Complexity:
463
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.062g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
296.344g/mol
Monoisotopic Mass:
296.062g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
74.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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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