Basic information
- CAS
6314-40-5- Standard SMILES
O=C(Nc1ccccc1)c1cc2ccccc2s1- InChIKey
QFWHYKVMOFOKHM-UHFFFAOYSA-N- Molecular formula
- C15H11NOS
- Average molar mass
- 253.32 g/mol
- Monoisotopic mass
- 253.05613497
Names & identifiers
- Preferred name
- N-phenyl-1-benzothiophene-2-carboxamide
- IUPAC
- N-phenyl-1-benzothiophene-2-carboxamide
- English name
- Benzo[b]thiophene-2-carboxamide,N-phenyl-
- Molecular formula
- C15H11NOS
- Molecular weight
- 253.31894
Names & synonyms
6314-40-5N-phenyl-1-benzothiophene-2-carboxamideA|A42 agonist-2Abeta42 agonist-2Benzo[b]thiophene-2-carboxanilideNSC40284N-Phenylbenzo[b]thiophene-2-carboxamideMLS002608207N-Phenyl-1-benzo[b]thiophene-2-carboxamidebenzothiophene-2-carboxanilideorb2566886SCHEMBL1853197
Show more names
Aβ42 agonist-2Benzo[b]thiophene-2-carboxamide,N-phenyl-
SCHEMBL6794112SCHEMBL6794115CHEMBL1734491DTXSID70285044QFWHYKVMOFOKHM-UHFFFAOYSA-NHMS3078J06N-phenylbenzothiophene-2-carboxamideNSC-40284
Database identifiers
- CAS
6314-40-5- PubChem CID
- 237071
- DTXSID
DTXSID70285044- ChEMBL
CHEMBL1734491- Nikkaji
- J2.844.182G
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 57.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 301
Physicochemical properties
- form
- Solid
- color
- White to off-white
Chemistry & industry
Applications
UsesAβ42 agonist-2 (compound 7b) is a small molecule compound that can promote Aβ42 aggregation. Aβ42 agonist-2 can interact with Aβ42 oligomers and pentamers to promote nontoxic aggregate self-assembly and rapid fibril formation. Aβ42 agonist-2 prevents Aβ42-induced cytotoxicity in HT22 hippocampal neuronal cells[1].
Upstream & downstream products
Downstream products
Suppliers8 total
江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
韶关市启程生物科技有限公司18122215013 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
天津凯利奇生物科技有限公司15076683720 · [email protected]
上海超岚化工科技中心QQ：65489617 13301690235 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
济南九黎生物科技有限公司15865264761 · [email protected]
Related reactions
1 records
Compound notes
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