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590395-70-3 | Acetamide, 2-(3,5-dimethylphenoxy)-N-[3-(5-ethyl-2-benzoxazolyl)phenyl]- (9CI)
CAS No: 590395-70-3 Catalog No: AG00EMEK MDL No:
Product Description
Catalog Number:
AG00EMEK
Chemical Name:
Acetamide, 2-(3,5-dimethylphenoxy)-N-[3-(5-ethyl-2-benzoxazolyl)phenyl]- (9CI)
CAS Number:
590395-70-3
IUPAC Name:
2-(3,5-dimethylphenoxy)-N-[3-(5-ethyl-1,3-benzoxazol-2-yl)phenyl]acetamide
InChI:
InChI=1S/C25H24N2O3/c1-4-18-8-9-23-22(13-18)27-25(30-23)19-6-5-7-20(14-19)26-24(28)15-29-21-11-16(2)10-17(3)12-21/h5-14H,4,15H2,1-3H3,(H,26,28)
InChI Key:
CBBAVWPSMLQWAZ-UHFFFAOYSA-N
Properties
Complexity:
561
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
400.179g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
400.478g/mol
Monoisotopic Mass:
400.179g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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