Name: Ledoxantrone trihydrochloride
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HIT ID:HIT218833036
Cas No:119221-49-7
Common Name:Ledoxantrone trihydrochloride
alias:Ledoxantrone trihydrochloride(113457-05-9 Free base)
alias:Ledoxantrone trihydrochloride(113457-05-9 Free base)
IUPAC:10-[(2-aminoethyl)amino]-14-[2-(diethylamino)ethyl]-8-thia-14,15-diazatetracyclo[7.6.1.0^{2,7}.0^{13,16}]hexadeca-1(15),2(7),3,5,9(16),10,12-heptaen-5-ol trihydrochloride
IUPAC:10-[(2-aminoethyl)amino]-14-[2-(diethylamino)ethyl]-8-thia-14,15-diazatetracyclo[7.6.1.0^{2,7}.0^{13,16}]hexadeca-1(15),2(7),3,5,9(16),10,12-heptaen-5-ol trihydrochloride
InChIKey:RNZAEKUSZHXFMR-UHFFFAOYSA-N

Molecular Formula:C21H30Cl3N5OS
Molecular Weight:506.92
Hydrogen Bond Donor (HBD):
Hydrogen Bond Acceptor (HBA):
LogP:
SMILES:Cl.Cl.Cl.CCN(CC)CCn1nc2c3c1ccc(NCCN)c3sc1cc(O)ccc21
SMILES:Cl.Cl.Cl.CCN(CC)CCn1nc2c3c1ccc(NCCN)c3sc1cc(O)ccc21

Ledoxantrone trihydrochloride is a Top II inhibitor with anticancer activity and is used in the study of digestive disorders and urologic disorders.

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