structure of 6-(Benzyloxy)pyrimidine-2,4-diamine

6-(Benzyloxy)pyrimidine-2,4-diamine

CAS No.: 100061-59-4
M. Wt: 216.23900
M. Fa: C11H12N4O
InChI Key: MVIHQMTVQZOYCE-UHFFFAOYSA-N

Names and Identifiers of 6-(Benzyloxy)pyrimidine-2,4-diamine

CAS Number

100061-59-4

IUPAC Name

6-phenylmethoxypyrimidine-2,4-diamine

InChI

InChI=1S/C11H12N4O/c12-9-6-10(15-11(13)14-9)16-7-8-4-2-1-3-5-8/h1-6H,7H2,(H4,12,13,14,15)

InChIKey

MVIHQMTVQZOYCE-UHFFFAOYSA-N

Canonical SMILES

C1=CC=C(C=C1)COC2=NC(=NC(=C2)N)N

Physical and chemical properties of 6-(Benzyloxy)pyrimidine-2,4-diamine

Exact Mass

216.10100

LogP

2.38240

Melting Point

104-106oC

Molecular Formula

C11H12N4O

Molecular Weight

216.23900

PSA

87.05000

Solubility

DMSO (Slightly), Methanol (Slightly)

Storage condition

Refrigerator

Applications of 6-(Benzyloxy)pyrimidine-2,4-diamine

The primary applications of 2,6-diamino-4-(benzyloxy)pyrimidine lie in medicinal chemistry and drug development. Its antiproliferative properties make it a candidate for further investigation as a potential anticancer agent. Additionally, its structural analogs may serve as lead compounds for developing new therapies targeting specific diseases, particularly those involving dysregulated cell growth.

Interaction Studies of 6-(Benzyloxy)pyrimidine-2,4-diamine

Interaction studies have focused on understanding how 2,6-diamino-4-(benzyloxy)pyrimidine interacts with various biological targets. These studies often employ techniques such as molecular docking and enzymatic assays to elucidate binding affinities and mechanisms of action. The compound's ability to inhibit specific kinases has been noted, suggesting that it could play a role in modulating critical signaling pathways involved in cancer biology.

Biological Activity of 6-(Benzyloxy)pyrimidine-2,4-diamine

Research indicates that 2,6-diamino-4-(benzyloxy)pyrimidine exhibits significant antiproliferative activity against various cancer cell lines. Its mechanism of action may involve the inhibition of specific kinases or other molecular targets involved in cell proliferation and survival. Studies have shown that pyrimidine derivatives can modulate signaling pathways related to cancer progression, making them valuable candidates for anticancer therapies.

Retrosynthesis analysis of 6-(Benzyloxy)pyrimidine-2,4-diamine

  • Route#1

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