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SI-2

CAT: 0931-T28773-04Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T28773-04Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
223788-33-8
Target
Others, Apoptosis, Src
Related Pathways
Apoptosis, Tyrosine Kinase/Adaptors, Others, Angiogenesis
Purity
0.984
Bioactivity
SI-2 is an inhibitor (SMI) of steroid receptor coactivator-3 (SRC-3 or AIB1) . SI-2 can selectively reduce the transcriptional activities and the protein concentrations of SRC-3 in cells, and selectively induce breast cancer cell death with IC50 values in the low nanomolar range (3-20 nM), but not affect normal cell viability.
Smiles
CN1C=2C(N=C1NN=C(C)C3=CC=CC=N3)=CC=CC2
Molecular Formula
C15H15N5
Molecular Weight
265.31
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

1-Methyl-N-[(E)-1-pyridin-2-ylethylideneamino]benzimidazol-2-amine
CAS Number223788-33-8
PubChem CID10220948
IUPAC Name1-methyl-N-[(E)-1-pyridin-2-ylethylideneamino]benzimidazol-2-amine
Molecular FormulaC15H15N5
Molecular Weight265.31
XLogP2.9
Topological Polar Surface Area55.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count20
Formal Charge0
Complexity356
SMILES
C/C(=N\NC1=NC2=CC=CC=C2N1C)/C3=CC=CC=N3
InChI
InChI=1S/C15H15N5/c1-11(12-7-5-6-10-16-12)18-19-15-17-13-8-3-4-9-14(13)20(15)2/h3-10H,1-2H3,(H,17,19)/b18-11+
InChIKey
JNNXERNBPXXNLK-WOJGMQOQSA-N
Chemical Structure
2D Structure
2D structure of 1-Methyl-N-[(E)-1-pyridin-2-ylethylideneamino]benzimidazol-2-amine
CAS: 223788-33-8
CID: 10220948
Formula: C15H15N5
MW: 265.31
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight265.31
XLogP32.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass265.13274550
Monoisotopic Mass265.13274550
Topological Polar Surface Area55.1 Ų
Heavy Atom Count20
Formal Charge0
Complexity356
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes