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IGOT1-01

CAT: 0931-T8765-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-T8765-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
882256-55-5
Target
Others
Related Pathways
Others
Purity
0.9983
Bioactivity
IGOT1-01 is an effective inhibitor of glutamate oxaloacetate transaminase 1 (GOT1) . iGOT1-01 has IC50s of 84.6 μM and 11.3 μM in GOT1/MDH1 assay and GOT1/GLOX/HRP assay, respectively. iGOT1-01 can be used in anti-cancer studies.
Smiles
O=C(Nc1ccccc1)N1CCN(CC1)c1cccc2[nH]ccc12
Molecular Formula
C19H20N4O
Molecular Weight
320.39
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

4-(1H-indol-4-yl)-N-phenylpiperazine-1-carboxamide
CAS Number882256-55-5
PubChem CID2818038
IUPAC Name4-(1H-indol-4-yl)-N-phenylpiperazine-1-carboxamide
Molecular FormulaC19H20N4O
Molecular Weight320.4
XLogP2.8
Topological Polar Surface Area51.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count24
Formal Charge0
Complexity429
SMILES
C1CN(CCN1C2=CC=CC3=C2C=CN3)C(=O)NC4=CC=CC=C4
InChI
InChI=1S/C19H20N4O/c24-19(21-15-5-2-1-3-6-15)23-13-11-22(12-14-23)18-8-4-7-17-16(18)9-10-20-17/h1-10,20H,11-14H2,(H,21,24)
InChIKey
MGSDOEMLWKEWSV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-(1H-indol-4-yl)-N-phenylpiperazine-1-carboxamide
CAS: 882256-55-5
CID: 2818038
Formula: C19H20N4O
MW: 320.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight320.4
XLogP32.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass320.16371127
Monoisotopic Mass320.16371127
Topological Polar Surface Area51.4 Ų
Heavy Atom Count24
Formal Charge0
Complexity429
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes