Responsive image

Common name


Busulfan

IUPAC name


4-(methanesulfonyloxy)butyl methanesulfonate

SMILES


CS(=O)(=O)OCCCCOS(C)(=O)=O

Compound class


Antineoplastic Agents; Immunosuppressive Agents; Antineoplastic Agents, Alkylating; Alkylating Agents; Myeloablative Agonists; Antineoplastic and Immunomodulating Agents; Alkyl Sulfonates; CYP3A4 Inhibitors;

Therapeutic area


For use in combination with cyclophosphamide as a conditioning regimen prior to allogeneic hematopoietic progenitor cell transplantation for chronic myelogenous (myeloid, myelocytic, granulocytic) leukemia (FDA has designated busulfan as an orphan drug for this use). It is also used as a component of pretransplant conditioning regimens in patients undergoing bone marrow transplantation for acute myeloid leukemia and nonmalignant diseases.

Common name


Busulfan

IUPAC name


4-(methanesulfonyloxy)butyl methanesulfonate

SMILES


CS(=O)(=O)OCCCCOS(C)(=O)=O

INCHI


InChI=1S/C6H14O6S2/c1-13(7,8)11-5-3-4-6-12-14(2,9)10/h3-6H2,1-2H3

FORMULA


C6H14O6S2

Responsive image

Common name


Busulfan

IUPAC name


4-(methanesulfonyloxy)butyl methanesulfonate

Molecular weight


246.302

clogP


-0.608

clogS


-1.611

HBond Acceptor


6

HBond Donor


0

Total Polar
Surface Area


86.74

Number of Rings


0

Rotatable Bond


7

Drug ID Common name Structure CAS SMILE Frequency
FDBF00416 butan-1-ol Responsive image C(CC)CO 0.0134
11 , 2