Responsive image

Common name


iprobenfos

IUPAC name


O,O-bis(1-methylethyl) S-(phenylmethyl) phosphorothioate

SMILES


CC(C)OP(=O)(OC(C)C)SCc1ccccc1

Compound class


Fungicide

Therapeutic area


Fungicide

Common name


iprobenfos

IUPAC name


O,O-bis(1-methylethyl) S-(phenylmethyl) phosphorothioate

SMILES


CC(C)OP(=O)(OC(C)C)SCc1ccccc1

INCHI


InChI=1S/C13H21O3PS/c1-11(2)15-17(14,16-12(3)4)18-10-13-8-6-5-7-9-13/h5-9,11-12H,10H2,1-4H3

FORMULA


C13H21O3PS

Responsive image

Common name


iprobenfos

IUPAC name


O,O-bis(1-methylethyl) S-(phenylmethyl) phosphorothioate

Molecular weight


288.343

clogP


2.506

clogS


-3.295

HBond Acceptor


3

HBond Donor


0

Total Polar
Surface Area


60.83

Number of Rings


1

Rotatable Bond


7

Drug ID Common name Structure CAS SMILE Frequency
FDBF00005 benzene Responsive image c1ccccc1 0.2824
FDBF00007 propane Responsive image C(C)C 0.2412
FDBF00023 toluene Responsive image c1(ccccc1)C 0.1268
FDBF01018 phenylmethanethiol Responsive image SCc1ccccc1 0.0034
4 , 1