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13238-64-7 | N-(4-oxo-2-thioxo-1,3-thiazolidin-3-yl)-N'-phenylurea
CAS No: 13238-64-7 Catalog No: AG00JF1T MDL No:MFCD00262974
Product Description
Catalog Number:
AG00JF1T
Chemical Name:
N-(4-oxo-2-thioxo-1,3-thiazolidin-3-yl)-N'-phenylurea
CAS Number:
13238-64-7
Molecular Formula:
C10H9N3O2S2
Molecular Weight:
267.3274
MDL Number:
MFCD00262974
IUPAC Name:
1-(4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-3-phenylurea
InChI:
InChI=1S/C10H9N3O2S2/c14-8-6-17-10(16)13(8)12-9(15)11-7-4-2-1-3-5-7/h1-5H,6H2,(H2,11,12,15)
InChI Key:
HFRDTOICPKLHJO-UHFFFAOYSA-N
SMILES:
O=C(NN1C(=S)SCC1=O)Nc1ccccc1
Properties
Complexity:
342
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.014g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
267.321g/mol
Monoisotopic Mass:
267.014g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
119A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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