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Iso-H7 dihydrochloride

CAT: 0931-T7501-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T7501-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
140663-38-3
Target
PKC, PKA
Related Pathways
Cytoskeletal Signaling, Chromatin/Epigenetic, Tyrosine Kinase/Adaptors
Purity
0.9988
Bioactivity
Iso-H7 dihydrochloride is a less potent inhibitor of phosphokinase C than H-7.
Smiles
Cl.Cl.CC1CN(CCN1)S(=O)(=O)c1cccc2cnccc12
Molecular Formula
C14H19Cl2N3O2S
Molecular Weight
364.29
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

1-(5-Isoquinolinylsulfonyl)-3-methylpiperazine dihydrochloride
CAS Number140663-38-3
PubChem CID11957580
IUPAC Name5-(3-methylpiperazin-1-yl)sulfonylisoquinoline;dihydrochloride
Molecular FormulaC14H19Cl2N3O2S
Molecular Weight364.3
Topological Polar Surface Area70.7
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count22
Formal Charge0
Complexity434
SMILES
CC1CN(CCN1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3.Cl.Cl
InChI
InChI=1S/C14H17N3O2S.2ClH/c1-11-10-17(8-7-16-11)20(18,19)14-4-2-3-12-9-15-6-5-13(12)14;;/h2-6,9,11,16H,7-8,10H2,1H3;2*1H
InChIKey
YHYNDFTUZMEYNX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(5-Isoquinolinylsulfonyl)-3-methylpiperazine dihydrochloride
CAS: 140663-38-3
CID: 11957580
Formula: C14H19Cl2N3O2S
MW: 364.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight364.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass363.0575034
Monoisotopic Mass363.0575034
Topological Polar Surface Area70.7 Ų
Heavy Atom Count22
Formal Charge0
Complexity434
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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Alternative Products

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