Lifitegrast


Chemical Name: Lifitegrast
CAS Number: 1025967-78-5
Product Number: AG0007UU(AGN-PC-0WALWS)
Synonyms:
MDL No:
Molecular Formula: C29H24Cl2N2O7S
Molecular Weight: 615.4811

Identification/Properties


Computed Properties
Molecular Weight:
615.478g/mol
XLogP3:
4.7
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
7
Exact Mass:
614.068g/mol
Monoisotopic Mass:
614.068g/mol
Topological Polar Surface Area:
142A^2
Heavy Atom Count:
41
Formal Charge:
0
Complexity:
1100
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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