Home Halogens Benzeneacetic acid,3-[6-[[2-(2,4-dichlorophenyl)ethyl]amino]-2-methoxy-4-pyrimidinyl]-a,a-dimethyl-

Benzeneacetic acid,3-[6-[[2-(2,4-dichlorophenyl)ethyl]amino]-2-methoxy-4-pyrimidinyl]-a,a-dimethyl-

CAS No.:
885066-67-1
Catalog Number:
AG01DU9P
Molecular Formula:
C23H23Cl2N3O3
Molecular Weight:
460.3530
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
98%
1 week
United States
$357
- +
10mg
98%
1 week
United States
$523
- +
50mg
98%
1 week
United States
$1307
- +
100mg
98%
1 week
United States
$2057
- +
Product Description
Catalog Number:
AG01DU9P
Chemical Name:
Benzeneacetic acid,3-[6-[[2-(2,4-dichlorophenyl)ethyl]amino]-2-methoxy-4-pyrimidinyl]-a,a-dimethyl-
CAS Number:
885066-67-1
Molecular Formula:
C23H23Cl2N3O3
Molecular Weight:
460.3530
MDL Number:
MFCD30721575
IUPAC Name:
2-[3-[6-[2-(2,4-dichlorophenyl)ethylamino]-2-methoxypyrimidin-4-yl]phenyl]-2-methylpropanoic acid
InChI:
InChI=1S/C23H23Cl2N3O3/c1-23(2,21(29)30)16-6-4-5-15(11-16)19-13-20(28-22(27-19)31-3)26-10-9-14-7-8-17(24)12-18(14)25/h4-8,11-13H,9-10H2,1-3H3,(H,29,30)(H,26,27,28)
InChI Key:
FJKKCRCBBAXLQZ-UHFFFAOYSA-N
SMILES:
COc1nc(NCCc2ccc(cc2Cl)Cl)cc(n1)c1cccc(c1)C(C(=O)O)(C)C
Properties
Complexity:
594  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
459.112g/mol
Formal Charge:
0
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
460.355g/mol
Monoisotopic Mass:
459.112g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
84.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.1  
Properties