Products for Research Use Only
RegisterLogin

SP-96

CAT: 0931-T41256-04Size: 10 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T41256-04Size:10 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
2682114-54-9
Target
Aurora Kinase
Related Pathways
Cell Cycle/Checkpoint, Chromatin/Epigenetic
Purity
0.9954
Bioactivity
SP-96 is a highly effective and selective inhibitor of Aurora B with an IC50 of 0.316 nM. SP-96 shows selective growth inhibition in NCI60 screening, including MDA-MD-468 (GI50=107 nM) . SP-96 can be used in triple negative breast cancer studies.
Smiles
Cn1cc(cn1)-c1ccc2c(Nc3cccc(NC(=O)Nc4cccc(F)c4)c3)ncnc2c1
Molecular Formula
C25H20FN7O
Molecular Weight
453.47
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

1-(3-Fluorophenyl)-3-(3-((7-(1-methyl-1H-pyrazol-4-yl)quinazolin-4-yl)amino)phenyl)urea
CAS Number2682114-54-9
PubChem CID154573766
IUPAC Name1-(3-fluorophenyl)-3-[3-[[7-(1-methylpyrazol-4-yl)quinazolin-4-yl]amino]phenyl]urea
Molecular FormulaC25H20FN7O
Molecular Weight453.5
XLogP4
Topological Polar Surface Area96.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count34
Formal Charge0
Complexity684
SMILES
CN1C=C(C=N1)C2=CC3=C(C=C2)C(=NC=N3)NC4=CC(=CC=C4)NC(=O)NC5=CC(=CC=C5)F
InChI
InChI=1S/C25H20FN7O/c1-33-14-17(13-29-33)16-8-9-22-23(10-16)27-15-28-24(22)30-20-6-3-7-21(12-20)32-25(34)31-19-5-2-4-18(26)11-19/h2-15H,1H3,(H,27,28,30)(H2,31,32,34)
InChIKey
CGDYRZUPKPBLND-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(3-Fluorophenyl)-3-(3-((7-(1-methyl-1H-pyrazol-4-yl)quinazolin-4-yl)amino)phenyl)urea
CAS: 2682114-54-9
CID: 154573766
Formula: C25H20FN7O
MW: 453.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight453.5
XLogP34
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass453.17133645
Monoisotopic Mass453.17133645
Topological Polar Surface Area96.8 Ų
Heavy Atom Count34
Formal Charge0
Complexity684
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

Related Products

CatalogName
T13085Targaprimir-96
T86687-01HSD17B13-IN-96
T212125-01α-Glucosidase-IN-96
T208979-01EGFR-IN-96
T71639-01AUH-6-96
T61170-01Antibacterial agent 96
T78970-01Antitumor agent-96
T209462-01Antifungal agent 96
T83073-01Anticancer agent 96
T74059-01Targaprimir-96 TFA

Alternative Products

CatalogName
BA3720-50SP-96
A24089-100SP-96 100mg
A24089-5SP-96 5mg
A24089-50SP-96 50mg
A24089-10SP-96 10mg
FLFAIO1075T96FLAME FAST Campylobacter sp-Salmonella sp-Legionella sp ALL-IN-1 Multi Kit - 96 rxn (0,2 tubes)
FLFAIO1075Z96FLAME FAST Campylobacter sp-Salmonella sp-Legionella sp ALL-IN-1 Multi Kit - 96 rxn (0,1 tubes)
FLFMAIO1075Z96FLAME FAST Campylobacter sp-Salmonella sp-Legionella sp ALL-IN-1 Multi Kitw/MB-96 rx (0,1 tubes)
FLFMAIO1075T96FLAME FAST Campylobacter sp-Salmonella sp-Legionella sp ALL-IN-1 Multi Kit w/MB-96 rxn (0,2 tub)
58-9696BMV1LU CELLS 96 WELL/ 96 FILL

Popular Products