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63123-26-2 | 3-ethyl-5-[2-(3-ethyl-(3H)-benzoxazol-2-ylidene)-1-methylethylidene]-2-thioxothiazolidin-4-one
CAS No: 63123-26-2 Catalog No: AG00EUBJ MDL No:
Product Description
Catalog Number:
AG00EUBJ
Chemical Name:
3-ethyl-5-[2-(3-ethyl-(3H)-benzoxazol-2-ylidene)-1-methylethylidene]-2-thioxothiazolidin-4-one
CAS Number:
63123-26-2
IUPAC Name:
3-ethyl-5-[1-(3-ethyl-1,3-benzoxazol-2-ylidene)propan-2-ylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
InChI:
InChI=1S/C17H18N2O2S2/c1-4-18-12-8-6-7-9-13(12)21-14(18)10-11(3)15-16(20)19(5-2)17(22)23-15/h6-10H,4-5H2,1-3H3
InChI Key:
WSSGAKXTPGFJFO-UHFFFAOYSA-N
EC Number:
263-873-9
Properties
Complexity:
585
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
346.081g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
346.463g/mol
Monoisotopic Mass:
346.081g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
90.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
4.6
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