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CAS 1269440-60-9

:

Methyl N-[(1S)-2-[[4-[3-iodo-1-(1-methylethyl)-1H-pyrazol-4-yl]-2-pyrimidinyl]amino]-1-methylethyl]carbamate

Description:
Methyl N-[(1S)-2-[[4-[3-iodo-1-(1-methylethyl)-1H-pyrazol-4-yl]-2-pyrimidinyl]amino]-1-methylethyl]carbamate, identified by its CAS number 1269440-60-9, is a chemical compound characterized by its complex molecular structure, which includes a carbamate functional group and multiple heterocyclic rings. This compound features a chiral center, contributing to its stereochemistry, and contains iodine, which may influence its reactivity and biological activity. The presence of both pyrazole and pyrimidine rings suggests potential applications in medicinal chemistry, particularly in the development of pharmaceuticals targeting specific biological pathways. Its molecular interactions may be significant in enzyme inhibition or receptor binding, making it a candidate for further research in drug discovery. Additionally, the methyl and isopropyl groups in its structure may enhance lipophilicity, affecting its solubility and permeability in biological systems. Overall, this compound exemplifies the intricate design often found in bioactive molecules, warranting detailed investigation for potential therapeutic uses.
Formula:C15H21IN6O2
InChI:InChI=1S/C15H21IN6O2/c1-9(2)22-8-11(13(16)21-22)12-5-6-17-14(20-12)18-7-10(3)19-15(23)24-4/h5-6,8-10H,7H2,1-4H3,(H,19,23)(H,17,18,20)/t10-/m0/s1
InChI key:InChIKey=VWEMYHDJVJQLKH-JTQLQIEISA-N
SMILES:IC=1C(=CN(C(C)C)N1)C2=NC(NC[C@@H](NC(OC)=O)C)=NC=C2
Synonyms:
  • Carbamic acid, N-[(1S)-2-[[4-[3-iodo-1-(1-methylethyl)-1H-pyrazol-4-yl]-2-pyrimidinyl]amino]-1-methylethyl]-, methyl ester
  • Methyl N-[(1S)-2-[[4-[3-iodo-1-(1-methylethyl)-1H-pyrazol-4-yl]-2-pyrimidinyl]amino]-1-methylethyl]carbamate
  • Methyl (S)-(1-((4-(3-iodo-1-isopropyl-1H-pyrazol-4-yl)pyrimi...
  • VWEMYHDJVJQLKH-JTQLQIEISA-N
  • (S)-methyl 1-(4-(3-iodo-1-isopropyl-1H-pyrazol-4-yl)pyrimidin-2-ylamino)propan-2-ylcarbamate
  • N-[(1S)-2-[[4-[3-Iodo-1-(1-methylethyl)-1H-pyrazol-4-yl]-2-pyrimidinyl]amino]-1-methylethyl]carbamic acid methyl ester
  • methyl (S)-(1-((4-(3-iodo-1-isopropyl-1H-pyrazol-4-yl)pyrimidin-2-yl)amino)propan-2-yl)carbamate
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