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590394-01-7 | Acetamide, 2-[5-methyl-2-(1-methylethyl)phenoxy]-N-[2-(4-pyridinyl)-5-benzoxazolyl]- (9CI)
CAS No: 590394-01-7 Catalog No: AG00EHQ9 MDL No:
Product Description
Catalog Number:
AG00EHQ9
Chemical Name:
Acetamide, 2-[5-methyl-2-(1-methylethyl)phenoxy]-N-[2-(4-pyridinyl)-5-benzoxazolyl]- (9CI)
CAS Number:
590394-01-7
IUPAC Name:
2-(5-methyl-2-propan-2-ylphenoxy)-N-(2-pyridin-4-yl-1,3-benzoxazol-5-yl)acetamide
InChI:
InChI=1S/C24H23N3O3/c1-15(2)19-6-4-16(3)12-22(19)29-14-23(28)26-18-5-7-21-20(13-18)27-24(30-21)17-8-10-25-11-9-17/h4-13,15H,14H2,1-3H3,(H,26,28)
InChI Key:
ZANCRTCBJSSDSY-UHFFFAOYSA-N
Properties
Complexity:
566
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
401.174g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
401.466g/mol
Monoisotopic Mass:
401.174g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
77.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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