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Chemical structure of Drp1-IN-1

GC64927

Drp1-IN-1

Also known as 4-methyl-1-[(2-piperidin-1-yl-1,3-thiazol-4-yl)methyl]-N-[4-(2H-tetrazol-5-yl)phenyl]pyrrole-2-carboxamide

Drp1-IN-1 (comp A-7) is a dynamin-1-like protein (Drp1) inhibitor, with an IC50 of 0·91 μM

ChemicalCAS2247733-08-8MW448.54FormulaC22H24N8OS
CAS number
2247733-08-8
Molecular weight
448.54
Formula
C22H24N8OS
Solubility
DMSO ： 100 mg/mL (222·95 mM; Need ultrasonic)
InChIKey
QNOOJEJAIFNEBQ-UHFFFAOYSA-N
Catalogue number
GC64927
Brand
GLPBIO
Computed properties PubChem CID 134817168 · XLogP 3.4 · TPSA 133 Ų · H-bond donors 2
XLogP
3.4
TPSA
133 Ų
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
32

SMILES CC1=CN(C(=C1)C(=O)NC2=CC=C(C=C2)C3=NNN=N3)CC4=CSC(=N4)N5CCCCC5

Computed descriptors from PubChem (CID 134817168), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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