Molecular Identity
Penconazole
1-[2-(2,4-dichlorophenyl)pentyl]-1,2,4-triazole
PubChem CID: 91693
1-[2-(2,4-dichlorophenyl)pentyl]1,2,4-triazole is a member of the classof triazoles that is 1,2,4-triazole substituted at position 1 by a 2-(2,4-dichlorophenyl)pentyl group. It is a dichlorobenzene and a member of triazoles.
2D Structure
Properties
C13H15Cl2N3
Molecular Formula
284.18
Molecular Weight
g/mol
283.0643
Exact Mass
Da
4.4
XLogP
Drug-like (Lipinski: < 5)
30.7
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
2
H-Bond Acceptors
252
Complexity
SMILES
Canonical SMILES
SMILES: CCCC(CN1C=NC=N1)C2=C(C=C(C=C2)Cl)ClIsomeric SMILES
SMILES: CCCC(CN1C=NC=N1)C2=C(C=C(C=C2)Cl)ClSynonyms(20)
Penconazole66246-88-6TopazetopasOnmexAward1-(2-(2,4-Dichlorophenyl)pentyl)-1H-1,2,4-triazoleDTXSID80422601H-1,2,4-Triazole, 1-[2-(2,4-dichlorophenyl)pentyl]-3UN9F9ZJ43CGA-718181-[2-(2,4-Dichlorophenyl)pentyl]-1H-1,2,4-triazole1H-1,2,4-Triazole, 1-(2-(2,4-dichlorophenyl)pentyl)-DTXCID6022260Gold Topaz
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Penconazole
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