Base information

Cat. No.
CAS No.1420880-41-6
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C24H22D4N6O3
Molecular Weight 450.526
Exact Mass 450.232
XLogP3 3.6566
Mr 123.748
PSA 129.81
Sequence -
Atom number 59
Bond number 62
Ring number 4
Rotor number 8
Residues number 0
Canonical smiles CCCc1nc(c(n1Cc1c([2H])c([2H])c(c(c1[2H])[2H])c1ccccc1c1n[nH]nn1)C(=O)O)C(O)(C)C

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