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DJ101

CAT: 0931-T24005-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T24005-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1803242-21-8
Target
Others, Microtubule Associated
Related Pathways
Others, Cytoskeletal Signaling
Bioactivity
DJ101is an effective and metabolically stable inhibitor of tubulin. It can circumvent the drug efflux pumps responsible for multidrug resistance of existing tubulin inhibitors.
Smiles
O(C)C=1C=C(C2=C3C(NC(=N3)C4=C5C(=CC=C4)NC=C5)=CC=N2)C=C(OC)C1OC
Molecular Formula
C23H20N4O3
Molecular Weight
400.43
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

2-(1H-indol-4-yl)-4-(3,4,5-trimethoxyphenyl)-1H-imidazo[4,5-c]pyridine
CAS Number1803242-21-8
PubChem CID122195227
IUPAC Name2-(1H-indol-4-yl)-4-(3,4,5-trimethoxyphenyl)-1H-imidazo[4,5-c]pyridine
Molecular FormulaC23H20N4O3
Molecular Weight400.4
XLogP3.8
Topological Polar Surface Area85.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count30
Formal Charge0
Complexity567
SMILES
COC1=CC(=CC(=C1OC)OC)C2=NC=CC3=C2N=C(N3)C4=C5C=CNC5=CC=C4
InChI
InChI=1S/C23H20N4O3/c1-28-18-11-13(12-19(29-2)22(18)30-3)20-21-17(8-10-25-20)26-23(27-21)15-5-4-6-16-14(15)7-9-24-16/h4-12,24H,1-3H3,(H,26,27)
InChIKey
GZJHBGSBVSNHCJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(1H-indol-4-yl)-4-(3,4,5-trimethoxyphenyl)-1H-imidazo[4,5-c]pyridine
CAS: 1803242-21-8
CID: 122195227
Formula: C23H20N4O3
MW: 400.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight400.4
XLogP33.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass400.15354051
Monoisotopic Mass400.15354051
Topological Polar Surface Area85.1 Ų
Heavy Atom Count30
Formal Charge0
Complexity567
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

Alternative Products

CatalogName
BA4257-1DJ101

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