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YM-58483

CAT: 0013-GTR19163024-01Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19163024-01Size:200 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
A store-operated Ca2+ entry blocker and CRAC channel inhibitor with IC50 of 100 nM; inhibits Ca (2+) influx through SOC channels without affecting the TCR signal transduction cascade in Jurkat cells, inhibits thapsigargin-induced sustained Ca (2+) influx (IC50=100 nM), and 30-fold less potent against Cav channels; potently inhibits IL-2 production and NF-AT-driven promoter activity in Jurkat cells; also inhibits IL-4 and IL-5 production Th2 T cells, prevents antigen-induced inflammatory responses in animal models; orally active.
CAS Number
223499-30-7
Product Name Alternative
YM58483 | YM 58483 | BPT2
Purity
>98% (HPLC)
Solubility
DMSO: ≥ 32 mg/mL
Smiles
O=C (C1=C (C) N=NS1) NC2=CC=C (N3N=C (C (F) (F) F) C=C3C (F) (F) F) C=C2
Molecular Formula
C15H9F6N5OS
Molecular Weight
421.3203
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.
Other Product Names
1,2,3-Thiadiazole-5-carboxamide, N-[4-[3,5-bis (trifluoromethyl) -1H-pyrazol-1-yl]phenyl]-4-methyl-

Chemical Information

4-methyl-4'-(3,5-bis(trifluoromethyl)-1H-pyrazol-1-yl)-1,2,3-thiadiazole-5-carboxanilide

potently inhibits store-operated sustained Ca2+ influx and IL-2 production in T lymphocytes

CAS Number223499-30-7
PubChem CID2455
IUPAC NameN-[4-[3,5-bis(trifluoromethyl)pyrazol-1-yl]phenyl]-4-methylthiadiazole-5-carboxamide
Molecular FormulaC15H9F6N5OS
Molecular Weight421.3
XLogP3.8
Topological Polar Surface Area101
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count11
Rotatable Bond Count3
Heavy Atom Count28
Formal Charge0
Complexity568
SMILES
CC1=C(SN=N1)C(=O)NC2=CC=C(C=C2)N3C(=CC(=N3)C(F)(F)F)C(F)(F)F
InChI
InChI=1S/C15H9F6N5OS/c1-7-12(28-25-23-7)13(27)22-8-2-4-9(5-3-8)26-11(15(19,20)21)6-10(24-26)14(16,17)18/h2-6H,1H3,(H,22,27)
InChIKey
XPRZIORDEVHURQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-methyl-4'-(3,5-bis(trifluoromethyl)-1H-pyrazol-1-yl)-1,2,3-thiadiazole-5-carboxanilide
CAS: 223499-30-7
CID: 2455
Formula: C15H9F6N5OS
MW: 421.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight421.3
XLogP33.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count11
Rotatable Bond Count3
Exact Mass421.04320007
Monoisotopic Mass421.04320007
Topological Polar Surface Area101 Ų
Heavy Atom Count28
Formal Charge0
Complexity568
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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