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CCCTP

CAT: 0931-T70387-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T70387-03Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1610952-07-2
Target
Others
Related Pathways
Others
Bioactivity
CCCTP is a potent inhibitor of the 11β-HSD-1 enzyme with reduced pregnane-X receptor (PXR) transactivation activity.
Smiles
ClC1=CC=C(C2(CC2)C=3N4C(=NN3)C(=CC=C4)C5CC5)C=C1
Molecular Formula
C18H16ClN3
Molecular Weight
309.79
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

3-[1-(4-Chlorophenyl)cyclopropyl]-8-Cyclopropyl[1,2,4]triazolo[4,3-A]pyridine
CAS Number1610952-07-2
PubChem CID118709259
IUPAC Name3-[1-(4-chlorophenyl)cyclopropyl]-8-cyclopropyl-[1,2,4]triazolo[4,3-a]pyridine
Molecular FormulaC18H16ClN3
Molecular Weight309.8
XLogP5
Topological Polar Surface Area30.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count22
Formal Charge0
Complexity426
SMILES
C1CC1C2=CC=CN3C2=NN=C3C4(CC4)C5=CC=C(C=C5)Cl
InChI
InChI=1S/C18H16ClN3/c19-14-7-5-13(6-8-14)18(9-10-18)17-21-20-16-15(12-3-4-12)2-1-11-22(16)17/h1-2,5-8,11-12H,3-4,9-10H2
InChIKey
DSIKPABWAOKGSR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-[1-(4-Chlorophenyl)cyclopropyl]-8-Cyclopropyl[1,2,4]triazolo[4,3-A]pyridine
CAS: 1610952-07-2
CID: 118709259
Formula: C18H16ClN3
MW: 309.8
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight309.8
XLogP35
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass309.1032752
Monoisotopic Mass309.1032752
Topological Polar Surface Area30.2 Ų
Heavy Atom Count22
Formal Charge0
Complexity426
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

Related Products

CatalogName
T7081-01CCCP

Alternative Products

CatalogName
MBS5812928CCCTP