Cas no 125402-92-8 (L-Glutamic acid,N-[4-[4-(2-amino-1,4-dihydro-6-methyl-4-oxo-5-pyrimidinyl)butyl]benzoyl]-)

L-Glutamic acid,N-[4-[4-(2-amino-1,4-dihydro-6-methyl-4-oxo-5-pyrimidinyl)butyl]benzoyl]- structure
125402-92-8 structure
Product Name:L-Glutamic acid,N-[4-[4-(2-amino-1,4-dihydro-6-methyl-4-oxo-5-pyrimidinyl)butyl]benzoyl]-
CAS No:125402-92-8
MF:C21H26N4O6
MW:430.454345226288
CID:1218108
Update Time:2024-08-03

L-Glutamic acid,N-[4-[4-(2-amino-1,4-dihydro-6-methyl-4-oxo-5-pyrimidinyl)butyl]benzoyl]- Chemical and Physical Properties

Names and Identifiers

    • L-Glutamic acid,N-[4-[4-(2-amino-1,4-dihydro-6-methyl-4-oxo-5-pyrimidinyl)butyl]benzoyl]-
    • L-Glutamic acid, N-[4-[4-(2-amino-1,4-dihydro-6-methyl-4-oxo-5-pyrimidinyl)butyl]benzoyl]- (9CI)
    • Inchi: 1S/C21H26N4O6/c1-12-15(19(29)25-21(22)23-12)5-3-2-4-13-6-8-14(9-7-13)18(28)24-16(20(30)31)10-11-17(26)27/h6-9,16H,2-5,10-11H2,1H3,(H,24,28)(H,26,27)(H,30,31)(H3,22,23,25,29)/t16-/m0/s1
    • InChI Key: AEMDLHXBCDSMLG-INIZCTEOSA-N
    • SMILES: C(O)(=O)[C@H](CCC(O)=O)NC(=O)C1=CC=C(CCCCC2=C(C)NC(N)=NC2=O)C=C1

Computed Properties

  • Exact Mass: 430.18538

Experimental Properties

  • Density: 1.40±0.1 g/cm3(Predicted)
  • PSA: 171.18
  • pka: 3.60±0.10(Predicted)
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