Base information

Cat. No.
CAS No.2107273-64-1
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C44H66ClN5O10
Molecular Weight 860.475
Exact Mass 859.45
XLogP3 2.87136
Mr 238.539
PSA 148.3
Sequence -
Atom number 126
Bond number 128
Ring number 4
Rotor number 31
Residues number 0
Canonical smiles COCCOCCOCCOCCOc1ccc2c(c1)C(C)(C)C(=[N+]2C)C=CC=C1N(C)c2c(C1(C)C)cc(cc2)OCCOCCOCCOCCOCCN=[N+]=[N-].[Cl-]

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