Responsive image

Common name


Fluconazole

IUPAC name


2-(2,4-difluorophenyl)-1,3-bis(1H-1,2,4-triazol-1-yl)propan-2-ol

SMILES


OC(CN1C=NC=N1)(CN1C=NC=N1)C1=C(F)C=C(F)C=C1

Compound class


Antifungal Agents; 14-alpha Demethylase Inhibitors; Antibacterials for Systemic Use; Antiinfectives for Systemic Use; Dermatologicals; Imidazole and Triazole Derivatives; Antifungals for Topical Use; Antifungals for Dermatological Use; Triazole Derivatives; Antimycotics for Systemic Use; Cytochrome P-450 CYP2C9 Inhibitors; Cytochrome P-450 CYP2C9 Inducers; Cytochrome P-450 CYP2C19 Inducers; CYP3A4 Inhibitors; Combined Inhibitors of CYP3A4 and P-glycoprotein;

Therapeutic area


For the treatment of fungal infections.

Common name


Fluconazole

IUPAC name


2-(2,4-difluorophenyl)-1,3-bis(1H-1,2,4-triazol-1-yl)propan-2-ol

SMILES


OC(CN1C=NC=N1)(CN1C=NC=N1)C1=C(F)C=C(F)C=C1

INCHI


InChI=1S/C13H12F2N6O/c14-10-1-2-11(12(15)3-10)13(22,4-20-8-16-6-18-20)5-21-9-17-7-19-21/h1-3,6-9,22H,4-5H2

FORMULA


C13H12F2N6O

Responsive image

Common name


Fluconazole

IUPAC name


2-(2,4-difluorophenyl)-1,3-bis(1H-1,2,4-triazol-1-yl)propan-2-ol

Molecular weight


306.271

clogP


0.714

clogS


-2.481

HBond Acceptor


5

HBond Donor


1

Total Polar
Surface Area


81.65

Number of Rings


3

Rotatable Bond


5

Drug ID Common name Structure CAS SMILE Frequency
FDBF00042 propan-2-ol Responsive image CC(O)C 0.0278
FDBF00263 (2R)-1-(1,2,4-triazol-1-yl)propan-2-ol Responsive image C(O)(Cn1ncnc1)C 0.0003
FDBF00269 1,3-difluorobenzene Responsive image Fc1cccc(c1)F 0.0072
13 , 2