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CAS 146464-94-0

:

1,5-Diethyl N-[4-[1-[(2,4-diamino-6-pteridinyl)methyl]-3-butyn-1-yl]benzoyl]-L-glutamate

Description:
1,5-Diethyl N-[4-[1-[(2,4-diamino-6-pteridinyl)methyl]-3-butyn-1-yl]benzoyl]-L-glutamate, with CAS number 146464-94-0, is a synthetic compound primarily studied for its potential applications in medicinal chemistry, particularly in the field of cancer treatment. This compound features a complex structure that includes a pteridine moiety, which is often associated with biological activity, particularly in relation to folate metabolism and enzyme inhibition. The presence of the diethyl and butynyl groups contributes to its lipophilicity, potentially influencing its bioavailability and interaction with biological membranes. Additionally, the glutamate component may play a role in receptor interactions or transport mechanisms within cells. As a result, this compound may exhibit unique pharmacological properties, making it a subject of interest in drug development research. However, detailed studies on its efficacy, safety, and mechanism of action are essential to fully understand its potential therapeutic applications.
Formula:C27H31N7O5
InChI:InChI=1S/C27H31N7O5/c1-4-7-18(14-19-15-30-24-22(31-19)23(28)33-27(29)34-24)16-8-10-17(11-9-16)25(36)32-20(26(37)39-6-3)12-13-21(35)38-5-2/h1,8-11,15,18,20H,5-7,12-14H2,2-3H3,(H,32,36)(H4,28,29,30,33,34)/t18?,20-/m0/s1
InChI key:InChIKey=XCONKISSMJXYPX-IJHRGXPZSA-N
SMILES:NC=1C2=C(N=CC(CC(CC#C)C3=CC=C(C(N[C@@H](CCC(OCC)=O)C(OCC)=O)=O)C=C3)=N2)N=C(N)N1
Synonyms:
  • L-Glutamic acid, N-[4-[1-[(2,4-diamino-6-pteridinyl)methyl]-3-butyn-1-yl]benzoyl]-, 1,5-diethyl ester
  • L-Glutamic acid, N-[4-[1-[(2,4-diamino-6-pteridinyl)methyl]-3-butynyl]benzoyl]-, diethyl ester
  • 1,5-Diethyl N-[4-[1-[(2,4-diamino-6-pteridinyl)methyl]-3-butyn-1-yl]benzoyl]-L-glutamate
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