Basic information
- CAS
89805-39-0- Standard SMILES
COc1ccc(CC[NH+](C)CCc2ccc(OC)c(OC)c2)cc1OC.[Cl-]- InChIKey
GYBONEHHSUABAO-UHFFFAOYSA-N- Molecular formula
- C21H30ClNO4
- Average molar mass
- 395.9 g/mol
- Monoisotopic mass
- 395.1863361
Overview
See other relationships...
Names & identifiers
- Preferred name
- Benzeneethanamine, N-(2-(3,4-dimethoxyphenyl)ethyl)-3,4-dimethoxy-N-methyl-, hydrochloride
- IUPAC
- bis[2-(3,4-dimethoxyphenyl)ethyl]-methylazanium chloride
- English name
- YS-035 hydrochloride
- Molecular formula
- C21H30ClNO4
- Molecular weight
- 395.92
Names & synonyms
Benzeneethanamine, N-(2-(3,4-dimethoxyphenyl)ethyl)-3,4-dimethoxy-N-methyl-, hydrochloridebis[2-(3,4-dimethoxyphenyl)ethyl]-methylazanium;chlorideMR-827YS 0353,3',4,4'-Tetramethoxy-N-methyldiphenethylamine hydrochlorideYS-035 hydrochlorideGYBONEHHSUABAO-UHFFFAOYSA-NDobutamine Impurity 42(Hydrochloride)YS 035 hydrochloride,YS035 hydrochlorideN,N-Bis(2-(3,4-dimethoxyphenyl)ethyl)methylamine hydrochlorideN,N-BIS-(3,4-DIMETHOXYPHENYLETHYL)-N-METHYLAMINE HYDROCHLORIDEN-(-2-[3,4-DIMETHOXYPHENYL]ETHYL)-3,4-DIMETHOXY-N-METHYLBENZENEETHANAMINE HYDROCHLORIDE
Database identifiers
- CAS
89805-39-0- PubChem CID
- 56017
Properties
Computed structural properties
- Topological polar surface area
- 41.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 347
Physicochemical properties
- storage temp.
- Desiccate at RT
- solubility
- 1 mg/ml; · DMF: 1 mg/ml; DMSO: 5 mg/ml; PBS (pH 7.2): 5 mg/ml
- form
- Powder
- color
- White to off-white
- Water Solubility
- 100 mM · Soluble to 100 mM in water
- WGK Germany
- 3 · 3
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
Chemistry & industry
Applications
UsesYS-035 Hydrochloride, inhibits K+ outward/pacemaker current, that strikingly prolongs cardiac action potentials.
Suppliers16 total
Aladdin Scientific[email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
United Life Science020-82099279 18988968278 · [email protected]
MedBio脉铂医药021-69568360 18916172912 · [email protected]
学研惠（武汉）科技有限公司15727060112 · [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]
南通全益生物科技有限公司0513-66337626 18051384581 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
上海超岚化工科技中心QQ：65489617 13301690235 · [email protected]
湖北摩科生物科技有限公司18274848843 · [email protected]
上海林栎生物科技有限公司13761635123 · [email protected]
ATK CHEMICAL COMPANY LIMITED
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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