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Dynole 34-2

CAT: 0607-B7619-50Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0607-B7619-50Size:50 mg
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Description
Dynamin I inhibitor
CAS Number
1128165-88-7
Product Name Alternative
(Z)-2-cyano-3-(1-(3-(dimethylamino)propyl)-1H-indol-3-yl)-N-octylacrylamide
Field of Research
Membrane Transporter Ion Channel GTPase
Purity
0.98
Form
Yellow solid
Solubility
<20.43mg/ml in ethanol; <40.86mg/ml in DMSO
Smiles
O=C(/C(C#N)=C\C1=CN(C2=CC=CC=C21)CCCN(C)C)NCCCCCCCC
Molecular Formula
C25H36N4O
Molecular Weight
408.58
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

Dynole 34-2
CAS Number1128165-88-7
PubChem CID44157463
IUPAC Name(E)-2-cyano-3-[1-[3-(dimethylamino)propyl]indol-3-yl]-N-octylprop-2-enamide
Molecular FormulaC25H36N4O
Molecular Weight408.6
XLogP5.4
Topological Polar Surface Area61.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count13
Heavy Atom Count30
Formal Charge0
Complexity591
SMILES
CCCCCCCCNC(=O)/C(=C/C1=CN(C2=CC=CC=C21)CCCN(C)C)/C#N
InChI
InChI=1S/C25H36N4O/c1-4-5-6-7-8-11-15-27-25(30)21(19-26)18-22-20-29(17-12-16-28(2)3)24-14-10-9-13-23(22)24/h9-10,13-14,18,20H,4-8,11-12,15-17H2,1-3H3,(H,27,30)/b21-18+
InChIKey
MYIMRONQBLZJFI-DYTRJAOYSA-N
Chemical Structure
2D Structure
2D structure of Dynole 34-2
CAS: 1128165-88-7
CID: 44157463
Formula: C25H36N4O
MW: 408.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight408.6
XLogP35.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count13
Exact Mass408.28891178
Monoisotopic Mass408.28891178
Topological Polar Surface Area61.1 Ų
Heavy Atom Count30
Formal Charge0
Complexity591
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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