Products for Research Use Only

Malic enzyme inhibitor ME1

CAT: 1410-M33006-01Size: 1 mL x 10 mM in DMSODry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1410-M33006-01Size:1 mL x 10 mM in DMSO
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
Malic enzyme inhibitor ME1 (ME1) is a specific inhibitor of Malic enzyme (IC50 = 0.15 μM) . Malic enzyme inhibitor ME1 reduces cell viability/metabolic activity.
CAS Number
522649-59-8
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
351.4
Molecular Formula
C20H21N3O3
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

Malic Enzyme inhibitor ME1
CAS Number522649-59-8
PubChem CID2936632
IUPAC Name3-[4-(4-hydroxyphenyl)piperazin-1-yl]-1-phenylpyrrolidine-2,5-dione
Molecular FormulaC20H21N3O3
Molecular Weight351.4
XLogP2.1
Topological Polar Surface Area64.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count26
Formal Charge0
Complexity518
SMILES
C1CN(CCN1C2CC(=O)N(C2=O)C3=CC=CC=C3)C4=CC=C(C=C4)O
InChI
InChI=1S/C20H21N3O3/c24-17-8-6-15(7-9-17)21-10-12-22(13-11-21)18-14-19(25)23(20(18)26)16-4-2-1-3-5-16/h1-9,18,24H,10-14H2
InChIKey
JJFJQFJFFVLMCX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Malic Enzyme inhibitor ME1
CAS: 522649-59-8
CID: 2936632
Formula: C20H21N3O3
MW: 351.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight351.4
XLogP32.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass351.15829154
Monoisotopic Mass351.15829154
Topological Polar Surface Area64.1 Ų
Heavy Atom Count26
Formal Charge0
Complexity518
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes