AG00BF3O

Name: Hoechst 33258 analog
Brand: Angene Chemical
SKU: AG00BF3O

258843-62-8 | Hoechst 33258 analog

AG00BF3O

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CAS Number	258843-62-8
Catalog Number	AG00BF3O(AGN-PC-0R1RJX)
Chemical Name	Hoechst 33258 analog
IUPAC Name	4-[3-[6-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]phenoxy]butanoic acid
InChI	InChI=1S/C29H30N6O3/c1-34-11-13-35(14-12-34)21-8-10-24-26(18-21)33-29(31-24)20-7-9-23-25(17-20)32-28(30-23)19-4-2-5-22(16-19)38-15-3-6-27(36)37/h2,4-5,7-10,16-18H,3,6,11-15H2,1H3,(H,30,32)(H,31,33)(H,36,37)
InChI Key	QXQZJBBLMSBZHP-UHFFFAOYSA-N
MDL Number	MFCD25976768
Molecular Formula	C29H30N6O3
Molecular Weight	510.5869
SMILES	O=C(O)CCCOC1=CC=CC(C3=NC2=CC=C(C5=NC4=CC=C(N6CCN(C)CC6)C=C4N5)C=C2N3)=C1
Synonyms	Hoechst 33258 analog, 258843-62-8, SCHEMBL14091141, SCHEMBL16552182, DTXSID50477829, AKOS030526756, ZINC196177520, CS-1311, HY-15623, W-6102, 4-[3-[6-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]-1H-benzimidazol-2-yl]phenoxy]butanoic acid, 4-[3-[6-[6-(4-Methylpiperazino)-1H-benzimidazole-2-yl]-1H-benzimidazole-2-yl]phenoxy]butanoic acid, A15107,

Complexity	794
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	510.238g/mol
Formal Charge	0
Heavy Atom Count	38
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	510.598g/mol
Monoisotopic Mass	510.238g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	110A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited