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SKU | Size | Availability | Price | Qty |
---|---|---|---|---|
B190900-50mg | 50mg | Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding. | $717.90 |
Synonyms | 1429309-33-0 | 1-((4-Bromophenyl)sulfonyl)-4-chloro-5-nitro-1H-pyrrolo[2,3-b]pyridine | 1-(4-bromophenyl)sulfonyl-4-chloro-5-nitropyrrolo[2,3-b]pyridine | 1-(4-Bromophenylsulfonyl)-4-chloro-5-nitro-1H-pyrrolo[2,3-b]pyridine | 1-[(4-Bromophenyl)sulfonyl]-4-chloro- |
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Specifications & Purity | ≥95% |
Storage Temp | Room temperature |
Shipped In | Normal |
IUPAC Name | 1-(4-bromophenyl)sulfonyl-4-chloro-5-nitropyrrolo[2,3-b]pyridine |
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INCHI | InChI=1S/C13H7BrClN3O4S/c14-8-1-3-9(4-2-8)23(21,22)17-6-5-10-12(15)11(18(19)20)7-16-13(10)17/h1-7H |
InChi Key | KGBWZJPKJXWKGA-UHFFFAOYSA-N |
Canonical SMILES | C1=CC(=CC=C1S(=O)(=O)N2C=CC3=C(C(=CN=C32)[N+](=O)[O-])Cl)Br |
Isomeric SMILES | C1=CC(=CC=C1S(=O)(=O)N2C=CC3=C(C(=CN=C32)[N+](=O)[O-])Cl)Br |
PubChem CID | 86280246 |
Molecular Weight | 416.63 |
Molecular Weight | 416.630 g/mol |
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XLogP3 | 3.600 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 2 |
Exact Mass | 414.903 Da |
Monoisotopic Mass | 414.903 Da |
Topological Polar Surface Area | 106.000 Ų |
Heavy Atom Count | 23 |
Formal Charge | 0 |
Complexity | 559.000 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
The total count of all stereochemical bonds | 0 |
Covalently-Bonded Unit Count | 1 |