5-Bromo-N2-methyl-2,4-pyrimidinediamine - CAS 1074-49-3
Catalog: |
BB002081 |
Product Name: |
5-Bromo-N2-methyl-2,4-pyrimidinediamine |
CAS: |
1074-49-3 |
Synonyms: |
5-bromo-N2-methylpyrimidine-2,4-diamine; 5-bromo-2-N-methylpyrimidine-2,4-diamine |
IUPAC Name: | 5-bromo-2-N-methylpyrimidine-2,4-diamine |
Description: | 5-Bromo-N2-methyl-2,4-pyrimidinediamine (CAS# 1074-49-3 ) is a useful research chemical. |
Molecular Weight: | 203.04 |
Molecular Formula: | C5H7BrN4 |
Canonical SMILES: | CNC1=NC=C(C(=N1)N)Br |
InChI: | InChI=1S/C5H7BrN4/c1-8-5-9-2-3(6)4(7)10-5/h2H,1H3,(H3,7,8,9,10) |
InChI Key: | ZVYGMPAVRMMGAS-UHFFFAOYSA-N |
LogP: | 1.51720 |
Complexity: | 110 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 201.98541 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 201.98541 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 63.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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