1-[4-[3-(hydroxymethyl)anilino]pyridin-3-yl]sulfonyl-3-propan-2-ylurea


Chemical Name: 1-[4-[3-(hydroxymethyl)anilino]pyridin-3-yl]sulfonyl-3-propan-2-ylurea
CAS Number: 99300-68-2
Product Number: AG01CBTH(AGN-PC-001MJE)
Synonyms:
MDL No:
Molecular Formula: C16H20N4O4S
Molecular Weight: 364.4194

Identification/Properties


Computed Properties
Molecular Weight:
364.42g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
6
Exact Mass:
364.121g/mol
Monoisotopic Mass:
364.121g/mol
Topological Polar Surface Area:
129A^2
Heavy Atom Count:
25
Formal Charge:
0
Complexity:
535
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

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NMR Spectrum


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