diclobutrazole

Synonyms: "vigilex", "dicyclobutrazole", "vigil", "diclobutrazol", "1-(2,4-dichlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-ol"

Source: diclobutrazol is a systemic fungicide with bactericidal activity, mainly used in wood preservation, and as dwarfing agent for pot plants.

Identifiers:

IUPAC Name: 1-(2,4-dichlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-ol
CAS Number: 75736-33-3
PubChem ID: 53309
InChiKey: URDNHJIVMYZFRT-UHFFFAOYSA-N
Canonical SMILES: CC(C)(C)C(C(CC1=C(C=C(C=C1)Cl)Cl)N2C=NC=N2)O

Structural Properties:

Molecular Formula: C₁₅H₁₉Cl₂N₃O
Molecular Weight: 328.237

Pharmacophore Features:

Number of bond donors: 1
Number of bond acceptors: 3
Number of atoms different from hydrogen: 21

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2D structure (.sdf)
3D structure (.sdf)
3D structure (.mol2)
3D structure (.pdb)
3D structure (.pdbqt)

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Evidence Supporting This Chemical as an Endocrine Disruptor
TEDX List of Potential Endocrine Disruptors

Sanderson JT, Boerma J, Lansbergen GW, van den Berg M. 2002. Induction and inhibition of aromatase (CYP19) activity by various classes of pesticides in H295R human adrenocortical carcinoma cells. Toxicol Appl Pharmacol 182(1):44-54.