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66625-28-3 | (2Z)-2-[(4-methoxyphenyl)imino]-1,3-thiazolidin-4-one
CAS No: 66625-28-3 Catalog No: AG00JF09 MDL No:MFCD01364753
Product Description
Catalog Number:
AG00JF09
Chemical Name:
(2Z)-2-[(4-methoxyphenyl)imino]-1,3-thiazolidin-4-one
CAS Number:
66625-28-3
Molecular Formula:
C10H10N2O2S
Molecular Weight:
222.2636
MDL Number:
MFCD01364753
IUPAC Name:
2-(4-methoxyphenyl)imino-1,3-thiazolidin-4-one
InChI:
InChI=1S/C10H10N2O2S/c1-14-8-4-2-7(3-5-8)11-10-12-9(13)6-15-10/h2-5H,6H2,1H3,(H,11,12,13)
InChI Key:
CADDZOBCSQHROY-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)/N=C/1\SCC(=O)N1
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.046g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
222.262g/mol
Monoisotopic Mass:
222.046g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
76A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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