ChemicalBook--->CAS DataBase List--->1222781-70-5

1222781-70-5

1222781-70-5 Structure

1222781-70-5 Structure
IdentificationBack Directory
[Name]

ML 133 Hydrochloride
[CAS]

1222781-70-5
[Synonyms]

ML133 HCl
ML 133 Hydrochloride
CID 781301 hydrochloride
VU0404943-1 hydrchloride
SID 85281105 hydrochloride
ML 133 Hydrochloride USP/EP/BP
(4-Methoxybenzyl)(1-naphthylMethyl)aMine Hydrochloride
N-(4-methoxybenzyl)-1-(naphthalen-1-yl)methanamine hydrochloride
N-[(4-METHOXYPHENYL)METHYL]-1-NAPHTHALENEMETHANAMINE HYDROCHLORIDE
(4-methoxyphenyl)-N-(naphthalen-1-ylmethyl)methanamine hydrochloride
1-(4-methoxyphenyl)-N-(naphthalen-1-ylmethyl)methanamine hydrochloride
N-[(4-Methoxyphenyl)methyl]-1-naphthalenemethanamine hydrochloride (1:1)
1-Naphthalenemethanamine, N-[(4-methoxyphenyl)methyl]-, hydrochloride (1:1)
[Molecular Formula]

C19H20ClNO
[MDL Number]

MFCD20921521
[MOL File]

1222781-70-5.mol
[Molecular Weight]

313.821
Chemical PropertiesBack Directory
[Melting point ]

193-195°C
[storage temp. ]

2-8°C
[solubility ]

DMSO: ≥10mg/mL
[form ]

powder
[color ]

white to tan
[InChI]

1S/C19H19NO.ClH/c1-21-18-11-9-15(10-12-18)13-20-14-17-7-4-6-16-5-2-3-8-19(16)17;/h2-12,20H,13-14H2,1H3;1H
[InChIKey]

NGQIBUUFXDPHKT-UHFFFAOYSA-N
[SMILES]

Cl.COc1ccc(CNCc2cccc3ccccc23)cc1
Safety DataBack Directory
[Hazard Codes ]

Xn,N
[Risk Statements ]

22-37/38-41-50/53
[Safety Statements ]

26-39-60-61
[RIDADR ]

UN 3077 9 / PGIII
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Aquatic Acute 1
Eye Dam. 1
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Uses]

ML 133 is a selective inhibitor of inwardly rectifying Kir2.x potassium channels. ML 133 exhibits no effect on rKir1.1.
[Biological Activity]

ml133 is a selective potassium channel inhibitor for kir2.1 with ic50 of 1.8 μm (ph 7.4) and 290 nm (ph 8.5), has no effect on kir1.1 and weak activity for kir4.1 and kir7.1.
[Biochem/physiol Actions]

ML133 hydrochloride is a selective inhibitor of the Kir2 family of inward rectifier (IRK, KCNJ) potassium channels. ML133 inhibits Kir2.1 with IC50 of 1.8 μM at pH 7.4 and 290 nM at pH8.5. It exhibits little selectivity against other members of Kir2.x family channels, but has no effect on Kir1.1 (IC50 > 300 μM), and displays weak activity for Kir4.1 (76 μM) and Kir7.1 (33 μM), making ML133 the most selective small molecule inhibitor of the Kir family reported to date. It also showed modest selectivity versus hERG and a larger panel of GPCRs, ion channels and transporters.
[storage]

Store at +4°C
Spectrum DetailBack Directory
[Spectrum Detail]

ML 133 Hydrochloride(1222781-70-5)1HNMR
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