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SB705498

CAT: 0957-S2773-01Size: 5 mgDry Ice: YesHazardous: No
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CAT#:0957-S2773-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
SB705498 is a TRPV1 antagonist for hTRPV1, antagonizes capsaicin, acid, and heat activation of TRPV1 with IC50 of 3 nM, 0.1 nM and 6 nM, shows a degree of voltage dependence, exhibits >100-fold selectivity for TRPV1 over TRPM8. Phase 2.
CAS Number
501951-42-4
Target
TRP Channel
Activity
Neuronal Signaling
Molecular Formula
C17H16BrF3N4O
Storage Conditions
2 years -80 in solvent

Chemical Information

Sb-705498

SB-705498 has been investigated for the treatment of Rhinitis, Chronic Cough, and Non-allergic Rhinitis.

CAS Number501951-42-4
PubChem CID9910486
IUPAC Name1-(2-bromophenyl)-3-[(3R)-1-[5-(trifluoromethyl)-2-pyridinyl]pyrrolidin-3-yl]urea
Molecular FormulaC17H16BrF3N4O
Molecular Weight429.2
XLogP3.8
Topological Polar Surface Area57.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count26
Formal Charge0
Complexity493
SMILES
C1CN(C[C@@H]1NC(=O)NC2=CC=CC=C2Br)C3=NC=C(C=C3)C(F)(F)F
InChI
InChI=1S/C17H16BrF3N4O/c18-13-3-1-2-4-14(13)24-16(26)23-12-7-8-25(10-12)15-6-5-11(9-22-15)17(19,20)21/h1-6,9,12H,7-8,10H2,(H2,23,24,26)/t12-/m1/s1
InChIKey
JYILLRHXRVTRSH-GFCCVEGCSA-N
Chemical Structure
2D Structure
2D structure of Sb-705498
CAS: 501951-42-4
CID: 9910486
Formula: C17H16BrF3N4O
MW: 429.2
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight429.2
XLogP33.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass428.04596
Monoisotopic Mass428.04596
Topological Polar Surface Area57.3 Ų
Heavy Atom Count26
Formal Charge0
Complexity493
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

Alternative Products

CatalogName
C17057-01SB705498

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