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84332-09-2 | 5-Pyrimidinecarboxamide,2-amino-N-[3-(dimethylamino)propyl]-4-methoxy-
CAS No: 84332-09-2 Catalog No: AG00560Z MDL No:
Product Description
Catalog Number:
AG00560Z
Chemical Name:
5-Pyrimidinecarboxamide,2-amino-N-[3-(dimethylamino)propyl]-4-methoxy-
CAS Number:
84332-09-2
Molecular Formula:
C11H19N5O2
Molecular Weight:
253.3009
IUPAC Name:
2-amino-N-[3-(dimethylamino)propyl]-4-methoxypyrimidine-5-carboxamide
InChI:
InChI=1S/C11H19N5O2/c1-16(2)6-4-5-13-9(17)8-7-14-11(12)15-10(8)18-3/h7H,4-6H2,1-3H3,(H,13,17)(H2,12,14,15)
InChI Key:
BSUXTOILAVNPIM-UHFFFAOYSA-N
SMILES:
COc1nc(N)ncc1C(=O)NCCCN(C)C
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.154g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
253.306g/mol
Monoisotopic Mass:
253.154g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
93.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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