200,000+ products from a single source!
sales@angenechem.com
138779-29-0 | Acetamide, 2-[2-[(1R,2R)-2-(dimethylamino)-1-[5-(1,1-dimethylethyl)-2-methoxyphenyl]-1-hydroxypropyl]phenoxy]-, rel-
CAS No: 138779-29-0 Catalog No: AG0019JG MDL No:
Product Description
Catalog Number:
AG0019JG
Chemical Name:
Acetamide, 2-[2-[(1R,2R)-2-(dimethylamino)-1-[5-(1,1-dimethylethyl)-2-methoxyphenyl]-1-hydroxypropyl]phenoxy]-, rel-
CAS Number:
138779-29-0
Molecular Formula:
C24H34N2O4
Molecular Weight:
414.5378
IUPAC Name:
N-[2-[1-(5-tert-butyl-2-methoxyphenyl)-2-(dimethylamino)-1-hydroxypropyl]phenoxy]acetamide
InChI:
InChI=1S/C24H34N2O4/c1-16(26(6)7)24(28,19-11-9-10-12-22(19)30-25-17(2)27)20-15-18(23(3,4)5)13-14-21(20)29-8/h9-16,28H,1-8H3,(H,25,27)
InChI Key:
UISSDGTUKVABJS-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1[C@](c1ccccc1OCC(=O)N)([C@H](N(C)C)C)O)C(C)(C)C
Properties
Complexity:
562
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
414.252g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
414.546g/mol
Monoisotopic Mass:
414.252g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
71A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.