Base information

Cat. No.
CAS No.35038-32-5
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C37H42N4O6
Molecular Weight 638.753
Exact Mass 638.31
XLogP3 3.9915
Mr 192.745
PSA 135.2
Sequence -
Atom number 89
Bond number 93
Ring number 5
Rotor number 11
Residues number 0
Canonical smiles COC(=O)C/C/1=C\2/N=C([C@H]([C@@H]2CCC(=O)OC)C)/C=c/2\[nH]/c(=C\C3=N/C(=C\c4[nH]c1c(C(=O)OC)c4C)/C(=C3C)CC)/c(c2C)C=C

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