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CAS 1258400-23-5

:

4-[[[2-[(Acetyloxy)methyl]-7-chloro-3,4-dihydro-3-methyl-4-oxo-6-quinazolinyl]methyl]-2-propyn-1-ylamino]-N-(3-pyridinylmethyl)benzamide

Description:
The chemical substance with the name "4-[[[2-[(Acetyloxy)methyl]-7-chloro-3,4-dihydro-3-methyl-4-oxo-6-quinazolinyl]methyl]-2-propyn-1-ylamino]-N-(3-pyridinylmethyl)benzamide" and CAS number 1258400-23-5 is a complex organic compound characterized by its multi-functional groups and structural diversity. It features a quinazoline core, which is known for its biological activity, particularly in medicinal chemistry. The presence of an acetyloxy group suggests potential for esterification reactions, while the chloro and propynylamino substituents may influence its reactivity and pharmacological properties. The incorporation of a pyridinylmethyl moiety indicates potential interactions with biological targets, enhancing its utility in drug development. This compound may exhibit various properties such as solubility, stability, and biological activity, which are critical for its application in therapeutic contexts. Its intricate structure suggests that it could be investigated for potential roles in treating diseases, particularly those involving cellular signaling pathways or enzyme inhibition. Further studies would be necessary to elucidate its specific characteristics and potential applications.
Formula:C29H26ClN5O4
InChI:InChI=1S/C29H26ClN5O4/c1-4-12-35(23-9-7-21(8-10-23)28(37)32-16-20-6-5-11-31-15-20)17-22-13-24-26(14-25(22)30)33-27(18-39-19(2)36)34(3)29(24)38/h1,5-11,13-15H,12,16-18H2,2-3H3,(H,32,37)
InChI key:InChIKey=XPEUSHABIAJLCS-UHFFFAOYSA-N
SMILES:O=C1C=2C(N=C(COC(C)=O)N1C)=CC(Cl)=C(CN(CC#C)C3=CC=C(C(NCC=4C=CC=NC4)=O)C=C3)C2
Synonyms:
  • 4-[[[2-[(Acetyloxy)methyl]-7-chloro-3,4-dihydro-3-methyl-4-oxo-6-quinazolinyl]methyl]-2-propyn-1-ylamino]-N-(3-pyridinylmethyl)benzamide
  • (7-Chloro-3-methyl-4-oxo-6-((prop-2-ynyl(4-(pyridin-3-ylmethylcarbamoyl)phenyl)amino)methyl)-3,4-dihydroquinazolin-2-yl)methyl acetate
  • Benzamide, 4-[[[2-[(acetyloxy)methyl]-7-chloro-3,4-dihydro-3-methyl-4-oxo-6-quinazolinyl]methyl]-2-propyn-1-ylamino]-N-(3-pyridinylmethyl)-
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