Basic information
- CAS
663172-95-0- Standard SMILES
CC(C)(C)c1cc(-c2csc(CN)n2)cc(C(C)(C)C)c1O.Cl.Cl- InChIKey
POTWDNZJOKKEMK-UHFFFAOYSA-N- Molecular formula
- C18H28Cl2N2OS
- Average molar mass
- 391.4 g/mol
- Monoisotopic mass
- 390.1299401
Names & identifiers
- Preferred name
- BN-82451 dihydrochloride
- IUPAC
- 4-[2-(aminomethyl)-1,3-thiazol-4-yl]-2,6-ditert-butylphenol;dihydrochloride
- English name
- BN-82451
- Molecular formula
- C18H27ClN2OS
- Molecular weight
- 354.94
Names & synonyms
BN-82451 dihydrochloride663172-95-0UNII-16YI7EJW2P16YI7EJW2PBN-82451 HClPhenol, 4-(2-(aminomethyl)-4-thiazolyl)-2,6-bis(1,1-dimethylethyl)-, dihydrochloridePhenol, 4-(2-(aminomethyl)-4-thiazolyl)-2,6-bis(1,1-dimethylethyl)-, hydrochloride (1:2)4-[2-(aminomethyl)-1,3-thiazol-4-yl]-2,6-ditert-butylphenol;dihydrochlorideBN-82451 2HClBN-82451 (dihydrochloride)orb1700981AKOS040748034
Show more names
BN82451BBN-82451BN-82451BBN 82451BBN82451 HCl,BN 82451 HClBN-82451B 2HCl|||BN 82451B 2HCl
HY-119274T26878Q27251845
Database identifiers
- CAS
663172-95-0- PubChem CID
- 10249864
- UNII
- 16YI7EJW2P
Properties
Computed structural properties
- Topological polar surface area
- 87.4 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 350
Physicochemical properties
- FDA UNII
- 16 YI7EJW2P · 16YI7EJW2P
Chemistry & industry
Applications
UsesBN-82451 dihydrochloride, an orally active and CNS-penetrated antioxidant and a multitargeting neuroprotective agent, exert a significant protection in experimental animal models mimicking aspects of cerebral ischemia, Parkinson disease, Huntington disease, and more particularly amyotrophic lateral sclerosis[1][2].
Suppliers4 total
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
上海阿摩尔生物科技有限公司13370042665 18916960931 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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