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89099-77-4 | 2-Pyrimidinamine, 4-chloro-N-(2,2-diethoxyethyl)-6-(4-morpholinyl)-
CAS No: 89099-77-4 Catalog No: AG003ZYD MDL No:
Product Description
Catalog Number:
AG003ZYD
Chemical Name:
2-Pyrimidinamine, 4-chloro-N-(2,2-diethoxyethyl)-6-(4-morpholinyl)-
CAS Number:
89099-77-4
Molecular Formula:
C14H23ClN4O3
Molecular Weight:
330.8104
IUPAC Name:
4-chloro-N-(2,2-diethoxyethyl)-6-morpholin-4-ylpyrimidin-2-amine
InChI:
InChI=1S/C14H23ClN4O3/c1-3-21-13(22-4-2)10-16-14-17-11(15)9-12(18-14)19-5-7-20-8-6-19/h9,13H,3-8,10H2,1-2H3,(H,16,17,18)
InChI Key:
OQYHVHLANAEXPC-UHFFFAOYSA-N
SMILES:
CCOC(CNc1nc(Cl)cc(n1)N1CCOCC1)OCC
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.146g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
330.813g/mol
Monoisotopic Mass:
330.146g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
68.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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