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Ftase inhibitor III

CAT: 0013-GTR19189224Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19189224Size:5 mg
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Description
Ftase inhibitor III
CAS Number
2710375-18-9
Field of Research
Metabolism Research, Pharmacology & Drug Discovery
Smiles
Cc1nn (C) c (C) c1C (=O) N1CCN (Cc2nc3ccccc3n2CC (C) (C) C) CC1
Molecular Formula
C24H34N6O
Molecular Weight
422.577
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

FTase Inhibitor III
CAS Number2710375-18-9
PubChem CID156595851
IUPAC Name[4-[[1-(2,2-dimethylpropyl)benzimidazol-2-yl]methyl]piperazin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone
Molecular FormulaC24H34N6O
Molecular Weight422.6
XLogP3
Topological Polar Surface Area59.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count31
Formal Charge0
Complexity628
SMILES
CC1=C(C(=NN1C)C)C(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4N3CC(C)(C)C
InChI
InChI=1S/C24H34N6O/c1-17-22(18(2)27(6)26-17)23(31)29-13-11-28(12-14-29)15-21-25-19-9-7-8-10-20(19)30(21)16-24(3,4)5/h7-10H,11-16H2,1-6H3
InChIKey
YHWDDYZFKUHHMW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of FTase Inhibitor III
CAS: 2710375-18-9
CID: 156595851
Formula: C24H34N6O
MW: 422.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight422.6
XLogP33
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass422.27940973
Monoisotopic Mass422.27940973
Topological Polar Surface Area59.2 Ų
Heavy Atom Count31
Formal Charge0
Complexity628
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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