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1388816-81-6 | 5-Pyrimidinecarboxamide, 4-amino-2,6-dichloro-
CAS No: 1388816-81-6 Catalog No: AG0019R0 MDL No:
Product Description
Catalog Number:
AG0019R0
Chemical Name:
5-Pyrimidinecarboxamide, 4-amino-2,6-dichloro-
CAS Number:
1388816-81-6
Molecular Formula:
C5H4Cl2N4O
Molecular Weight:
207.0175
IUPAC Name:
4-amino-2,6-dichloropyrimidine-5-carboxamide
InChI:
InChI=1S/C5H4Cl2N4O/c6-2-1(4(9)12)3(8)11-5(7)10-2/h(H2,9,12)(H2,8,10,11)
InChI Key:
YMLKQABGWVTDJK-UHFFFAOYSA-N
SMILES:
Clc1nc(N)c(c(n1)Cl)C(=O)N
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.976g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
207.014g/mol
Monoisotopic Mass:
205.976g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
94.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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