Responsive image

Common name


Alprazolam

IUPAC name


12-chloro-3-methyl-9-phenyl-2,4,5,8-tetraazatricyclo[8.4.0.0²,⁶]tetradeca-1(10),3,5,8,11,13-hexaene

SMILES


CC1=NN=C2CN=C(C3=CC=CC=C3)C3=C(C=CC(Cl)=C3)N12

Compound class


Anti-Anxiety Agents; Hypnotics and Sedatives; GABA Modulators; Benzodiazepines; Nervous System; Benzodiazepine Derivatives; Anxiolytics; Psycholeptics; Cytochrome P-450 CYP2C9 Inhibitors; Cytochrome P-450 CYP2C9 Inducers; CYP3A4 Inhibitors;

Therapeutic area


For the management of anxiety disorder or the short-term relief of symptoms of anxiety and for the treatment of panic disorder, with or without agoraphobia.

Common name


Alprazolam

IUPAC name


12-chloro-3-methyl-9-phenyl-2,4,5,8-tetraazatricyclo[8.4.0.0²,⁶]tetradeca-1(10),3,5,8,11,13-hexaene

SMILES


CC1=NN=C2CN=C(C3=CC=CC=C3)C3=C(C=CC(Cl)=C3)N12

INCHI


InChI=1S/C17H13ClN4/c1-11-20-21-16-10-19-17(12-5-3-2-4-6-12)14-9-13(18)7-8-15(14)22(11)16/h2-9H,10H2,1H3

FORMULA


C17H13ClN4

Responsive image

Common name


Alprazolam

IUPAC name


12-chloro-3-methyl-9-phenyl-2,4,5,8-tetraazatricyclo[8.4.0.0²,⁶]tetradeca-1(10),3,5,8,11,13-hexaene

Molecular weight


308.765

clogP


4.164

clogS


-5.433

HBond Acceptor


3

HBond Donor


0

Total Polar
Surface Area


43.07

Number of Rings


4

Rotatable Bond


1

Drug ID Common name Structure CAS SMILE Frequency
FDBF00005 benzene Responsive image c1ccccc1 0.2824
FDBF00878 8-chloro-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine Responsive image Clc1cc2c(cc1)-n3c(nnc3C)CN=C2 0.0010
2 , 1