| CAS Number | 1242336-55-5 |
| Catalog Number | AG000LQL(AGN-PC-0WNN2J) |
| Chemical Name | N-(5-bromopyrimidin-2-yl)methanesulfonamide |
| IUPAC Name | N-(5-bromopyrimidin-2-yl)methanesulfonamide |
| InChI | InChI=1S/C5H6BrN3O2S/c1-12(10,11)9-5-7-2-4(6)3-8-5/h2-3H,1H3,(H,7,8,9) |
| InChI Key | MRNXHECJHFQUDD-UHFFFAOYSA-N |
| MDL Number | MFCD16660319 |
| Molecular Formula | C5H6BrN3O2S |
| Molecular Weight | 252.0890 |
| SMILES | CS(=O)(NC1=NC=C(Br)C=N1)=O |
| Synonyms | 1242336-55-5,
N-(5-Bromopyrimidin-2-yl)methanesulfonamide,
5-Bromo-2-(N-methylsufonylamino)pyrimidine,
C5H6BrN3O2S,
SCHEMBL18555412,
CTK8C5251,
DTXSID50682451,
ANW-74908,
MFCD16660319,
ZINC65337515,
AKOS015892591,
FCH1346960,
AK106528,
AX8243374,
TR-048411,
Z8753,
B-3684,
Methanesulfonamide, N-(5-bromo-2-pyrimidinyl)-,
I03-1443,
5-nitro-2-(piperidin-4-carboxamide-1-yl)-benzoic acid,
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| Complexity | 230 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 250.936g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 252.086g/mol |
| Monoisotopic Mass | 250.936g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 80.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number