N-(4-ethoxyphenyl)-4-[hydroxy(diphenyl)methyl]piperidine-1-carbothioamide


Chemical Name: N-(4-ethoxyphenyl)-4-[hydroxy(diphenyl)methyl]piperidine-1-carbothioamide
CAS Number: 443292-81-7
Product Number: AG00DGSR(AGN-PC-0KMUFL)
Synonyms:
MDL No: MFCD03032390
Molecular Formula: C27H30N2O2S
Molecular Weight: 446.6043

Identification/Properties


Computed Properties
Molecular Weight:
446.609g/mol
XLogP3:
5.1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
6
Exact Mass:
446.203g/mol
Monoisotopic Mass:
446.203g/mol
Topological Polar Surface Area:
76.8A^2
Heavy Atom Count:
32
Formal Charge:
0
Complexity:
554
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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