IUPAC name
1-[[2-(2,4-dichlorophenyl)-4-propyl-1,3-dioxolan-2-yl]methyl]-1H-1,2,4-triazole
SMILES
CCCC1COC(Cn2cncn2)(c2ccc(cc2Cl)Cl)O1
Compound class
Fungicide
Therapeutic area
Fungicide
Common name
propiconazole
IUPAC name
1-[[2-(2,4-dichlorophenyl)-4-propyl-1,3-dioxolan-2-yl]methyl]-1H-1,2,4-triazole
SMILES
CCCC1COC(Cn2cncn2)(c2ccc(cc2Cl)Cl)O1
INCHI
InChI=1S/C15H17Cl2N3O2/c1-2-3-12-7-21-15(22-12,8-20-10-18-9-19-20)13-5-4-11(16)6-14(13)17/h4-6,9-10,12H,2-3,7-8H2,1H3
FORMULA
C15H17Cl2N3O2
Common name
propiconazole
IUPAC name
1-[[2-(2,4-dichlorophenyl)-4-propyl-1,3-dioxolan-2-yl]methyl]-1H-1,2,4-triazole
Molecular weight
342.220
clogP
3.502
clogS
-4.666
HBond Acceptor
4
HBond Donor
0
Total Polar Surface Area
49.17
Number of Rings
3
Rotatable Bond
5
| Drug ID | Common name | Structure CAS | SMILE | Frequency |
|---|---|---|---|---|
| FDBF00520 | (4S)-4-methyl-1,3-dioxolane |
|
CC1OCOC1 | 0.0017 |
11 ,
2
