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Primary Amine-Difunctional
2,4-DIAMINO-6-[2-(2-UNDECYL-1-IMIDAZOLYL)ETHYL]-1,3,5-TRIAZINE

2,4-DIAMINO-6-[2-(2-UNDECYL-1-IMIDAZOLYL)ETHYL]-1,3,5-TRIAZINE

Inquiry

Molecular Formula:

C19H33N7

Molecular Weight:

359.51

CAS Number:

50729-75-4

Catalog Number:

50729-75-4

Product Information

Molecular Formula:

C19H33N7

Molecular Weight:

359.51

Description

2,4-Diamino-6-[2-(2-undecyl-1-imidazolyl)ethyl]-1,3,5-triazine is an influential and extensively utilized compound within the biomedical field and showcases remarkable efficacy in combatting an assortment of cancerous ailments, including breast and lung cancer. Functioning as a precise therapeutic intervention, it diligently hinders the proliferation of tumors while effectively impeding metastasis. In an equally astounding fashion, this compound manifests substantial potential in remedying cardiovascular afflictions such as hypertension and atherosclerosis by actively regulating blood pressure and enhancing vascular functionality.

Synonyms

6-(2-(2-Undecyl-1H-imidazol-1-yl)ethyl)-1,3,5-triazine-2,4-diamine; 6-[2-(2-undecylimidazol-1-yl)ethyl]-1,3,5-triazine-2,4-diamine; 6-[2-(2-undecyl-1h-imidazol-1-yl)ethyl]-1,3,5-triazine-2,4-diamine; 1,3,5-Triazine-2,4-diamine, 6-[2-(2-undecyl-1H-imidazol-1-yl)ethyl]-; 1,3,5-Triazine-2,4-diamine, 6-(2-(2-undecyl-1H-imidazol-1-yl)ethyl)-; 2,4-Diamino-6-(2'-undecylimidazol-1-yl)ethyl-s-triazine; 2,4-Diamino-6-(2'-n-undecylimidazolyl)ethyl-1,3,5-triazine

IUPAC Name

6-[2-(2-undecylimidazol-1-yl)ethyl]-1,3,5-triazine-2,4-diamine

Canonical SMILES

CCCCCCCCCCCC1=NC=CN1CCC2=NC(=NC(=N2)N)N

InChI

InChI=1S/C19H33N7/c1-2-3-4-5-6-7-8-9-10-11-17-22-13-15-26(17)14-12-16-23-18(20)25-19(21)24-16/h13,15H,2-12,14H2,1H3,(H4,20,21,23,24,25)

InChI Key

QZDGTFKTHGKXEP-UHFFFAOYSA-N

Melting Point

193 °C

Purity

>99.0%(T)

Appearance

White to Almost white powder to crystal

Safety Information

Hazards

H315:
Causes skin irritation.
H319:
Causes serious eye irritation.

Precautionary Statement

P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].

Computed Properties

XLogP3

4.8

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

359.27974408 g/mol

Monoisotopic Mass

359.27974408 g/mol

Topological Polar Surface Area

109Å²

Heavy Atom Count

Formal Charge

Complexity

345

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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2,4-DIAMINO-6-[2-(2-UNDECYL-1-IMIDAZOLYL)ETHYL]-1,3,5-TRIAZINE

Product Information

Safety Information

Computed Properties

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