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HS-72

CAT: 0931-T24151-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T24151-03Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1118861-60-1
Target
Others
Related Pathways
Others
Bioactivity
HS-72 is an allosteric inhibitor. It is also selective for the inducible form of Hsp70.
Smiles
C(CC)N1C=2C(N=C1NC(=O)C3CN(CCC3)C=4C=NC=CN4)=CC=CC2
Molecular Formula
C20H24N6O
Molecular Weight
364.44
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N-(1-propyl-1H-1,3-benzodiazol-2-yl)-1-(pyrazin-2-yl)piperidine-3-carboxamide
CAS Number1118861-60-1
PubChem CID42950709
IUPAC NameN-(1-propylbenzimidazol-2-yl)-1-pyrazin-2-ylpiperidine-3-carboxamide
Molecular FormulaC20H24N6O
Molecular Weight364.4
XLogP2.2
Topological Polar Surface Area75.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count27
Formal Charge0
Complexity503
SMILES
CCCN1C2=CC=CC=C2N=C1NC(=O)C3CCCN(C3)C4=NC=CN=C4
InChI
InChI=1S/C20H24N6O/c1-2-11-26-17-8-4-3-7-16(17)23-20(26)24-19(27)15-6-5-12-25(14-15)18-13-21-9-10-22-18/h3-4,7-10,13,15H,2,5-6,11-12,14H2,1H3,(H,23,24,27)
InChIKey
VWWVDRUMIVMLNJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(1-propyl-1H-1,3-benzodiazol-2-yl)-1-(pyrazin-2-yl)piperidine-3-carboxamide
CAS: 1118861-60-1
CID: 42950709
Formula: C20H24N6O
MW: 364.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight364.4
XLogP32.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass364.20115941
Monoisotopic Mass364.20115941
Topological Polar Surface Area75.9 Ų
Heavy Atom Count27
Formal Charge0
Complexity503
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