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TC-I2000

CAT: 1410-M21933-07Size: 200 mgDry Ice: NoHazardous: No
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CAT#:1410-M21933-07Size:200 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
TC-I2000 is an TRPM8 channel blocker. Inhibits icilin-induced TRPM8 channel activation in rTRPM8-expressing CHO cells with IC50 of 53 nM.
CAS Number
1159996-20-9
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
414.4
Molecular Formula
C23H18F4N2O
Notes
Research use only, not for human use.
Receptor
TRPM8

Chemical Information

N-(4-Fluorophenyl)-1-(4-(trifluoromethyl)phenyl)-3,4-dihydroisoquinoline-2(1H)-carboxamide
CAS Number1159996-20-9
PubChem CID57326210
IUPAC NameN-(4-fluorophenyl)-1-[4-(trifluoromethyl)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide
Molecular FormulaC23H18F4N2O
Molecular Weight414.4
XLogP5.3
Topological Polar Surface Area32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count30
Formal Charge0
Complexity582
SMILES
C1CN(C(C2=CC=CC=C21)C3=CC=C(C=C3)C(F)(F)F)C(=O)NC4=CC=C(C=C4)F
InChI
InChI=1S/C23H18F4N2O/c24-18-9-11-19(12-10-18)28-22(30)29-14-13-15-3-1-2-4-20(15)21(29)16-5-7-17(8-6-16)23(25,26)27/h1-12,21H,13-14H2,(H,28,30)
InChIKey
ADCDUDFEGFKKQH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(4-Fluorophenyl)-1-(4-(trifluoromethyl)phenyl)-3,4-dihydroisoquinoline-2(1H)-carboxamide
CAS: 1159996-20-9
CID: 57326210
Formula: C23H18F4N2O
MW: 414.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight414.4
XLogP35.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass414.13552585
Monoisotopic Mass414.13552585
Topological Polar Surface Area32.3 Ų
Heavy Atom Count30
Formal Charge0
Complexity582
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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