(S)-1-Boc-3-methylpiperazine

Synonym(s):tert-Butyl (S)-3-methyl-1-piperazinecarboxylate

CAS NO.：147081-29-6
Empirical Formula: C10H20N2O2
Molecular Weight: 200.28
MDL number: MFCD02683204
EINECS: 206-459-5
SAFETY DATA SHEET (SDS)
Update Date: 2024-04-15 15:30:59

What is (S)-1-Boc-3-methylpiperazine?

Description

(S)-1-Boc-3-methylpiperazine is a hydrophobic compound that is structurally modified from the tetracyclic family of drugs. It has been shown to inhibit tumor cell growth by binding to the oncogene, KRASG12C, and downregulating its expression. This compound also inhibits cancer cell growth through the inhibition of the PI3K/AKT signaling pathway. The pharmacological effects of (S)-1-Boc-3-methylpiperazine are dependent on its ability to bind with high affinity to KRASG12C and inhibit its activity.

Chemical properties

colorless to yellow liquid

The Uses of (S)-1-Boc-3-methylpiperazine

Laboratory chemicals, Manufacture of substances.

The Uses of (S)-1-Boc-3-methylpiperazine

(S)-4-Boc-2-methylpiperazine ((S)-1-Boc-3-methylpiperazine) is a reagent used in the synthesis of benzamide peptidomimetic as non-ATP competitive inihbitors.

The Uses of (S)-1-Boc-3-methylpiperazine

Reactant involved in the synthesis of biologically activy molecules including:

CCR5 antagonists with anti-HIV-1 activity
Opioid receptor antagonists
Human growth hormone secretagogue receptor antagonists for treatment of obesity
Fatty acid oxidation inhibitors

Properties of (S)-1-Boc-3-methylpiperazine

Melting point:	40-45 °C
Boiling point:	268.7±15.0 °C(Predicted)
alpha	-16 º (c=1 in dioxane)
Density	0.997±0.06 g/cm3(Predicted)
storage temp.	Keep in dark place,Inert atmosphere,2-8°C
form	Crystalline Powder
pka	8.52±0.40(Predicted)
color	White to yellow
optical activity	[α]/D -16±2°, c = 1 in dioxane
Sensitive	Air Sensitive
InChI	InChI=1S/C10H20N2O2/c1-8-7-12(6-5-11-8)9(13)14-10(2,3)4/h8,11H,5-7H2,1-4H3/t8-/m0/s1
CAS DataBase Reference	147081-29-6(CAS DataBase Reference)

Safety information for (S)-1-Boc-3-methylpiperazine

Signal word	Danger
Pictogram(s)	Corrosion Corrosives GHS05 Exclamation Mark Irritant GHS07
GHS Hazard Statements	H315:Skin corrosion/irritation H318:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes	P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of soap and water.