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372503-67-8 | 5-[(4-Ethoxy-3-methoxyphenyl)methylene]-2-(4-morpholinyl)-4(5H)-thiazolone
CAS No: 372503-67-8 Catalog No: AG01F4K3 MDL No:
Product Description
Catalog Number:
AG01F4K3
Chemical Name:
5-[(4-Ethoxy-3-methoxyphenyl)methylene]-2-(4-morpholinyl)-4(5H)-thiazolone
CAS Number:
372503-67-8
Molecular Formula:
C17H20N2O4S
Molecular Weight:
348.4167
IUPAC Name:
(5Z)-5-[(4-ethoxy-3-methoxyphenyl)methylidene]-2-morpholin-4-yl-1,3-thiazol-4-one
InChI:
InChI=1S/C17H20N2O4S/c1-3-23-13-5-4-12(10-14(13)21-2)11-15-16(20)18-17(24-15)19-6-8-22-9-7-19/h4-5,10-11H,3,6-9H2,1-2H3/b15-11-
InChI Key:
ZWYFYCLQWBXNDS-PTNGSMBKSA-N
SMILES:
CCOc1ccc(cc1OC)/C=C/1\SC(=NC1=O)N1CCOCC1
Properties
Complexity:
517
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
348.114g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
348.417g/mol
Monoisotopic Mass:
348.114g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
85.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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