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Necrosis inhibitor 2

CAT: 0931-T86989-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T86989-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2258671-03-1
Target
Others, Necroptosis
Related Pathways
Apoptosis, Others
Bioactivity
Necrosis Inhibitor 2 (Compound B19) serves as an inhibitor of cell necrosis. It is utilized in the research of diseases associated with the necrosis pathway, such as inflammation, tumors, metabolic diseases, and neurodegenerative diseases [1].
Smiles
C(OC1CCOCC1)(=O)N2C=3C(=NC=C(C3)C4=CN5C(C=C4)=NC(NC(=O)C6CC6)=C5)OCC2
Molecular Formula
C24H25N5O5
Molecular Weight
463.49
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Necrosis inhibitor 2
CAS Number2258671-03-1
PubChem CID147189908
IUPAC Nameoxan-4-yl 7-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]-2,3-dihydropyrido[2,3-b][1,4]oxazine-1-carboxylate
Molecular FormulaC24H25N5O5
Molecular Weight463.5
XLogP2.5
Topological Polar Surface Area107
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Heavy Atom Count34
Formal Charge0
Complexity760
SMILES
C1CC1C(=O)NC2=CN3C=C(C=CC3=N2)C4=CC5=C(N=C4)OCCN5C(=O)OC6CCOCC6
InChI
InChI=1S/C24H25N5O5/c30-22(15-1-2-15)27-20-14-28-13-16(3-4-21(28)26-20)17-11-19-23(25-12-17)33-10-7-29(19)24(31)34-18-5-8-32-9-6-18/h3-4,11-15,18H,1-2,5-10H2,(H,27,30)
InChIKey
CBFVEDWCRMVPSD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Necrosis inhibitor 2
CAS: 2258671-03-1
CID: 147189908
Formula: C24H25N5O5
MW: 463.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight463.5
XLogP32.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass463.18556891
Monoisotopic Mass463.18556891
Topological Polar Surface Area107 Ų
Heavy Atom Count34
Formal Charge0
Complexity760
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