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1-(4-methoxyphenyl)-N-[(4-propan-2-ylphenyl)methyl]benzimidazol-5-amine

HCID 178713402
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Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
489416-12-8
Standard SMILES
COc1ccc(-n2cnc3cc(NCc4ccc(C(C)C)cc4)ccc32)cc1
InChIKey
JPSZEXYTKSIPDW-UHFFFAOYSA-N
Molecular formula
C24H25N3O
Average molar mass
371.5 g/mol
Monoisotopic mass
371.19976243

Names & identifiers

Preferred name
1-(4-methoxyphenyl)-N-[(4-propan-2-ylphenyl)methyl]benzimidazol-5-amine
IUPAC
1-(4-methoxyphenyl)-N-[(4-propan-2-ylphenyl)methyl]benzimidazol-5-amine
English name
ST-193
Molecular formula
C24H25N3O
Molecular weight
371.47

Names & synonyms

ST-193489416-12-81-(4-methoxyphenyl)-N-[4-(propan-2-yl)benzyl]-1H-benzimidazol-5-amine1-(4-methoxyphenyl)-N-[(4-propan-2-ylphenyl)methyl]benzimidazol-5-amineN-(4-isopropylbenzyl)-1-(4-methoxyphenyl)-1H-benzo[d]imidazol-5-amineSCHEMBL769761orb1309062CHEMBL2314859EX-A4339PUA41612MFCD03296554STK071893
Show more names
ST-193 hydrochloridST-193, 10 mM in DMSOST193 HYDROCHLORIDEST 193 HYDROCHLORIDEST-193,inhibit,Inhibitor,Arenavirus,ST193,ST 1931H-Benzimidazol-5-amine, 1-(4-methoxyphenyl)-N-[[4-(1-methylethyl)phenyl]methyl]-
AKOS005389869CS-6473SB18672ST-193?DA-67768MS-25992HY-101441G13195

Database identifiers

CAS
489416-12-8
PubChem CID

Properties

Computed structural properties

XLogP
5.7
Topological polar surface area
39.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
28
Formal charge
0
Complexity
468

Physicochemical properties

Boiling point
562.5 · 562.5±60.0 °C(Predicted)
Density
1.12 · 1.12±0.1 g/cm3(Predicted)
storage temp.
-20 °C · Store at -20°C
solubility
150 mg/mL · DMSO: ≥ 150 mg/mL (403.80 mM)
pka
5.2 · 5.20±0.10(Predicted)
form
Solid
color
Off-white to pink

Chemistry & industry

Applications

UsesST-193 is a potent broad-spectrum arenavirus inhibitor; inhibits Guanarito, Junin, Lassa and Machupo virus with IC50 values of 0.44, 0.62, 1.4 and 3.1 nM, respectively.

Suppliers22 total

上海冬洋生物科技有限公司0512-13601744364 13601744364 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
銳迪國際科技有限公司18024082417 · [email protected]
北京博奥森生物技术有限公司400-901-9800 18611424007 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
开封明仁药业有限公司0371-65741762 · [email protected]
南通全益生物科技有限公司0513-66337626 18051384581 · [email protected]
风咏生物(AbMole)021-10000000 13000000000 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
BOC Sciences[email protected]
Shaanxi Dideu New Materials Co. Ltd18192503167 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
3697969
ChEMBL
CHEMBL2314859
Nikkaji
J2.983.048G
上海瀚香生物科技有限公司
17754423994 · [email protected]
天津凯芾医药科技有限公司18081075745 · [email protected]
TargetMol中国(陶术生物)4008200310 15002144251 · [email protected]
上海陌孚医药科技有限公司4000862158 18117107507 · [email protected]
ChemeGen 中国18818260767 · [email protected]
奥默生物技术(上海)有限公司19821158099 · [email protected]
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
上海阿摩尔生物科技有限公司13370042665 18916960931 · [email protected]
上海弘渠生物医药科技有限公司88888888888 · [email protected]
北京索莱宝科技有限公司17801761073 18101056239 · [email protected]