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Pomstafib-2

CAT: 0013-GTR19221686-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19221686-02Size:50 mg
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Description
Pomstafib-2 is a potent and selective STAT5b inhibitor that effectively suppresses pSTAT5b expression and triggers apoptosis. This small molecule is a valuable research tool for studying STAT5b-dependent pathways in oncology and immunology, with demonstrated utility in both in vitro and in vivo experimental models.
CAS Number
2332841-83-3
Field of Research
Cell Biology, Signal Transduction, Stem Cell & Developmental Biology
Smiles
CC (C) (C) C (=O) OCOP (=O) (OCOC (=O) C (C) (C) C) Oc1ccc (CNC (=O) COc2ccc (cc2) C (=O) Nc2ccc (Oc3ccccc3) cc2) cc1OP (=O) (OCOC (=O) C (C) (C) C) OCOC (=O) C (C) (C) C
Molecular Formula
C52H66N2O20P2
Molecular Weight
1101.03
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Pomstafib-2
CAS Number2332841-83-3
PubChem CID166642619
IUPAC Name[[2-[bis(2,2-dimethylpropanoyloxymethoxy)phosphoryloxy]-4-[[[2-[4-[(4-phenoxyphenyl)carbamoyl]phenoxy]acetyl]amino]methyl]phenoxy]-(2,2-dimethylpropanoyloxymethoxy)phosphoryl]oxymethyl 2,2-dimethylpropanoate
Molecular FormulaC52H66N2O20P2
Molecular Weight1101.0
XLogP9.5
Topological Polar Surface Area271
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count20
Rotatable Bond Count33
Heavy Atom Count76
Formal Charge0
Complexity1920
SMILES
CC(C)(C)C(=O)OCOP(=O)(OCOC(=O)C(C)(C)C)OC1=C(C=C(C=C1)CNC(=O)COC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4)OP(=O)(OCOC(=O)C(C)(C)C)OCOC(=O)C(C)(C)C
InChI
InChI=1S/C52H66N2O20P2/c1-49(2,3)45(57)64-31-68-75(61,69-32-65-46(58)50(4,5)6)73-41-27-18-35(28-42(41)74-76(62,70-33-66-47(59)51(7,8)9)71-34-67-48(60)52(10,11)12)29-53-43(55)30-63-38-23-19-36(20-24-38)44(56)54-37-21-25-40(26-22-37)72-39-16-14-13-15-17-39/h13-28H,29-34H2,1-12H3,(H,53,55)(H,54,56)
InChIKey
ZGQKQAXJQMLWPR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pomstafib-2
CAS: 2332841-83-3
CID: 166642619
Formula: C52H66N2O20P2
MW: 1101.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight1101.0
XLogP39.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count20
Rotatable Bond Count33
Exact Mass1100.36841649
Monoisotopic Mass1100.36841649
Topological Polar Surface Area271 Ų
Heavy Atom Count76
Formal Charge0
Complexity1920
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

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