Silsesquioxanes,Me
Product Information
Molecular Formula
C66H56N4
Description
Silsesquioxanes, Me is a cutting-edge multifunctional biocompatible compound. It finds extensive application in drug transport mechanisms and tissue reconstruction procedures. Distinguished for its unparalleled proficiency in drug dosage modulation and cellular substrate integration, Silsesquioxanes, Me stands as a staple remedy for an array of ailments encompassing cancer, cardiac anomalies, and neurologic afflictions.
Synonyms
POLY(METHYLSILSESQUIOXANE); Siliconeoilemulsion284P; Silsesquioxanes,me; poly(methylsilsesquioxane),100%methyl; METHYLSILSESQUIOXANE; POLY(METHYLSILSESQUIOXANE): 4.0-6.0% OH; POLY(METHYLSILSESQUIOXANE): 100% METHYL, 2.5-4% OH; POLY(PHENYL-VINYLSILSESQUIOXANE):
IUPAC Name
N'-[1-(4-cyclohexa-1,5-dien-1-ylcyclohexa-1,5-dien-1-yl)-3-(4-phenylphenyl)prop-1-enyl]-4-[9-[6-methyl-5-(2-methylphenyl)cyclohexa-1,5-dien-1-yl]carbazol-3-yl]carbazole-9-carboximidamide
SMILES
CC1=CC=CC=C1C2=C(C(=CCC2)N3C4=C(C=C(C=C4)C5=C6C7=CC=CC=C7N(C6=CC=C5)C(=NC(=CCC8=CC=C(C=C8)C9=CC=CC=C9)C1=CCC(C=C1)C1=CCCC=C1)N)C1=CC=CC=C13)C
InChI
InChI=1S/C66H56N4/c1-44-17-9-10-22-53(44)54-25-15-29-60(45(54)2)69-61-27-13-11-23-56(61)58-43-52(40-42-63(58)69)55-26-16-30-64-65(55)57-24-12-14-28-62(57)70(64)66(67)68-59(51-38-36-50(37-39-51)48-20-7-4-8-21-48)41-33-46-31-34-49(35-32-46)47-18-5-3-6-19-47/h3,5-7,9-14,16-24,26-32,34-36,38-43,50H,4,8,15,25,33,37H2,1-2H3,(H2,67,68)
InChI Key
IYKSBVLUZFFSST-UHFFFAOYSA-N
Density
1.08 g/cm3
Concentration
100% Methyl
Computed Properties
XLogP3
15.6
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
1
Rotatable Bond Count
10
Exact Mass
904.45049780 g/mol
Monoisotopic Mass
904.45049780 g/mol
Topological Polar Surface Area
48.2Ų
Heavy Atom Count
70
Formal Charge
0
Complexity
2100
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
1
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
1
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
