| CAS Number | 60703-81-3 |
| Catalog Number | AG00IAQJ(AGN-PC-0WBREB) |
| Chemical Name | 6-Bromothieno[2,3-d]pyrimidin-4-amine |
| IUPAC Name | 6-bromothieno[2,3-d]pyrimidin-4-amine |
| InChI | InChI=1S/C6H4BrN3S/c7-4-1-3-5(8)9-2-10-6(3)11-4/h1-2H,(H2,8,9,10) |
| InChI Key | IFWIWFFQSVCWSR-UHFFFAOYSA-N |
| MDL Number | MFCD27987642 |
| Molecular Formula | C6H4BrN3S |
| Molecular Weight | 230.0851 |
| SMILES | NC1=C(C=C(Br)S2)C2=NC=N1 |
| Synonyms | 6-bromothieno[2,3-d]pyrimidin-4-amine,
60703-81-3,
SCHEMBL6461918,
MFCD27987642,
ZINC82296449,
AKOS022657142,
FCH2516124,
SB14735,
KS-000005U8,
AK173853,
AS-52634,
CS-0050247,
Thieno[2,3-d]pyrimidin-4-amine, 6-bromo-,
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| Complexity | 157 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 228.931g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 230.083g/mol |
| Monoisotopic Mass | 228.931g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 80A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
Lot Number