| CAS Number | 1226389-57-6 |
| Catalog Number | AG01AUML |
| Chemical Name | 5-Bromo-2-(4-methylpiperazin-1-yl)pyridin-3-amine |
| IUPAC Name | 5-bromo-2-(4-methylpiperazin-1-yl)pyridin-3-amine |
| InChI | InChI=1S/C10H15BrN4/c1-14-2-4-15(5-3-14)10-9(12)6-8(11)7-13-10/h6-7H,2-5,12H2,1H3 |
| InChI Key | BBXKIRALZZZBSM-UHFFFAOYSA-N |
| MDL Number | MFCD14600437 |
| Molecular Formula | C10H15BrN4 |
| Molecular Weight | 271.1569 |
| SMILES | CN1CCN(C2=C(N)C=C(Br)C=N2)CC1 |
| Synonyms | 5-bromo-2-(4-methylpiperazin-1-yl)pyridin-3-amine,
1226389-57-6,
SCHEMBL20605140,
ZINC40713497,
AKOS010477980,
Z784893196,
|
| Complexity | 206 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 270.04801g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 271.16g/mol |
| Monoisotopic Mass | 270.04801g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 45.4Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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Certificate of Analysis
Lot Number