N-(1,1-Dimethylethyl)-3-[[5-methyl-2-[[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]amino]-4-pyrimidinyl]amino]benzenesulfonamide


Chemical Name: N-(1,1-Dimethylethyl)-3-[[5-methyl-2-[[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]amino]-4-pyrimidinyl]amino]benzenesulfonamide
CAS Number: 936091-26-8
Product Number: AG00GU70(AGN-PC-014TOD)
Synonyms:
MDL No: MFCD12922515
Molecular Formula: C27H36N6O3S
Molecular Weight: 524.6781

Identification/Properties


Computed Properties
Molecular Weight:
524.684g/mol
XLogP3:
4.8
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
9
Rotatable Bond Count:
11
Exact Mass:
524.257g/mol
Monoisotopic Mass:
524.257g/mol
Topological Polar Surface Area:
117A^2
Heavy Atom Count:
37
Formal Charge:
0
Complexity:
787
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


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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