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Chemical structure of T-1330

GC76959

T-1330

Also known as 2-butan-2-yl-4-[4-[4-(4-hydroxyphenyl)piperazin-1-yl]phenyl]-1,2,4-triazol-3-one

T-1330 (Compound 45) is a Hh pathway inhibitor and reduces Gli1 expression

ChemicalCAS106461-41-0MW393.48FormulaC22H27N5O2
CAS number
106461-41-0
Molecular weight
393.48
Formula
C22H27N5O2
InChIKey
FFAQILVGBAELHN-UHFFFAOYSA-N
Catalogue number
GC76959
Brand
GLPBIO
Computed properties PubChem CID 4445081 · XLogP 3.8 · TPSA 62.6 Ų · H-bond donors 1
XLogP
3.8
TPSA
62.6 Ų
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
29

SMILES CCC(C)N1C(=O)N(C=N1)C2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)O

Computed descriptors from PubChem (CID 4445081), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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