Home Halogens 4-(3-chloro-4-MethoxybenzylaMino)-5-ethoxycarbonyl-2-MethylsulfinylpyriMidine

4-(3-chloro-4-MethoxybenzylaMino)-5-ethoxycarbonyl-2-MethylsulfinylpyriMidine

CAS No.:
330785-82-5
Catalog Number:
AG00CAVC
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00CAVC
Chemical Name:
4-(3-chloro-4-MethoxybenzylaMino)-5-ethoxycarbonyl-2-MethylsulfinylpyriMidine
CAS Number:
330785-82-5
MDL Number:
MFCD25459252
IUPAC Name:
ethyl 4-[(3-chloro-4-methoxyphenyl)methylamino]-2-methylsulfinylpyrimidine-5-carboxylate
InChI:
InChI=1S/C16H18ClN3O4S/c1-4-24-15(21)11-9-19-16(25(3)22)20-14(11)18-8-10-5-6-13(23-2)12(17)7-10/h5-7,9H,4,8H2,1-3H3,(H,18,19,20)
InChI Key:
HPWWGZRNBFATPZ-UHFFFAOYSA-N
Properties
Complexity:
471  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
383.071g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
383.847g/mol
Monoisotopic Mass:
383.071g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties