SNAP-fusion protein ligand-1

Name: SNAP-fusion protein ligand-1
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CAS No. 913817-45-5
Cat. No. CS-0186854
Molecule weight264.71
Purity≥95%
MDL No.MFCD31568523

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General Information

CAS No. 913817-45-5
Cat. No. CS-0186854
Purity ≥95%
MDL No. MFCD31568523
Storage 4°C, stored under nitrogen, away from moisture
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₂H₁₃ClN₄O
Molecular Weight 264.71
Synonym(s) None
SMILES NC1=NC(Cl)=CC(OCC2=CC=C(CN)C=C2)=N1

Description

4-((4-(Aminomethyl)benzyl)oxy)-6-chloropyrimidin-2-amine features a pyrimidine core functionalized with chlorine and amino groups, enabling targeted conjugation in medicinal chemistry. The aminomethylbenzyl ether side chain provides solubility and facilitates derivatization, while the electron-deficient pyrimidine ring supports nucleophilic substitution reactions. This scaffold serves as a key building block for kinase inhibitors and antiviral agents.

Application

4-((4-(Aminomethyl)benzyl)oxy)-6-chloropyrimidin-2-amine serves as a versatile building block in medicinal chemistry, enabling the construction of pyrimidine-based scaffolds through standard coupling and functionalization reactions. The molecule combines a reactive chloropyrimidine core with a benzyl-linked aminomethyl group, facilitating nucleophilic substitution and derivatization under mild conditions. Its bench-stable nature and compatibility with diverse reaction environments support efficient synthesis workflows in API development.

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P501

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Computational Chemistry Data

TPSA 87.05
LogP 1.7499
H_Acceptors 5
H_Donors 2
Rotatable_Bonds 4

Other Classifications

Building Blocks Functional Group Chloride

Building Blocks Functional Group Ether

Building Blocks Skeleton Aromatic heterocycle compounds Pyrimidine compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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SNAP-fusion protein ligand-1

CAS No. 913817-45-5

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