Diltiazem


Chemical Name: Diltiazem
CAS Number: 42399-41-7
Product Number: AG01E75Y(AGN-PC-0WAIOD)
Synonyms:
MDL No:
Molecular Formula: C22H26N2O4S
Molecular Weight: 414.51784

Identification/Properties


Computed Properties
Molecular Weight:
414.52g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
7
Exact Mass:
414.161g/mol
Monoisotopic Mass:
414.161g/mol
Topological Polar Surface Area:
84.4A^2
Heavy Atom Count:
29
Formal Charge:
0
Complexity:
565
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
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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