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BMS-480404

CAT: 0013-GTR19195340-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19195340-03Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
BMS-480404 is a potent and selective small molecule inhibitor that targets the human keratinocyte fatty acid-binding protein (FABP5) . It is a valuable research tool for studying lipid signaling pathways in models of inflammation, cancer, and metabolic disease in both cellular and animal studies.
CAS Number
533889-36-0
Smiles
O (CC1=C (Cl) C=CC=C1) C2=C (OCC3=C (Cl) C=CC=C3) C=CC=C2[C@@H] (C (O) =O) O
Molecular Formula
C22H18Cl2O5
Molecular Weight
433.28
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Bms-480404
CAS Number533889-36-0
PubChem CID16046219
IUPAC Name(2S)-2-[2,3-bis[(2-chlorophenyl)methoxy]phenyl]-2-hydroxyacetic acid
Molecular FormulaC22H18Cl2O5
Molecular Weight433.3
XLogP5
Topological Polar Surface Area76
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Heavy Atom Count29
Formal Charge0
Complexity519
SMILES
C1=CC=C(C(=C1)COC2=CC=CC(=C2OCC3=CC=CC=C3Cl)[C@@H](C(=O)O)O)Cl
InChI
InChI=1S/C22H18Cl2O5/c23-17-9-3-1-6-14(17)12-28-19-11-5-8-16(20(25)22(26)27)21(19)29-13-15-7-2-4-10-18(15)24/h1-11,20,25H,12-13H2,(H,26,27)/t20-/m0/s1
InChIKey
NCWQPARYSYJFNI-FQEVSTJZSA-N
Chemical Structure
2D Structure
2D structure of Bms-480404
CAS: 533889-36-0
CID: 16046219
Formula: C22H18Cl2O5
MW: 433.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight433.3
XLogP35
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Exact Mass432.0531291
Monoisotopic Mass432.0531291
Topological Polar Surface Area76 Ų
Heavy Atom Count29
Formal Charge0
Complexity519
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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