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53230-08-3 | 4-[6-(4-Amidino-3-iodophenoxy)hexyloxy]benzamidine
CAS No: 53230-08-3 Catalog No: AG00DMVR MDL No:
Product Description
Catalog Number:
AG00DMVR
Chemical Name:
4-[6-(4-Amidino-3-iodophenoxy)hexyloxy]benzamidine
CAS Number:
53230-08-3
IUPAC Name:
4-[6-(4-carbamimidoylphenoxy)hexoxy]-2-iodobenzenecarboximidamide
InChI:
InChI=1S/C20H25IN4O2/c21-18-13-16(9-10-17(18)20(24)25)27-12-4-2-1-3-11-26-15-7-5-14(6-8-15)19(22)23/h5-10,13H,1-4,11-12H2,(H3,22,23)(H3,24,25)
InChI Key:
POTHBMQCQAUSHC-UHFFFAOYSA-N
Properties
Complexity:
469
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
480.102g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
480.35g/mol
Monoisotopic Mass:
480.102g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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