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Fasudil mesylate

CAT: 0013-GTR19235377-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19235377-01Size:25 mg
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Description
Fasudil mesylate (HA-1077) is an orally active, non-specific Rho kinase (ROCK) inhibitor with additional activity against PKA, PKC, and PKG. It also functions as a calcium channel antagonist and vasodilator. This small molecule is widely used in cardiovascular and neurological disease research, including in vitro enzyme assays and in vivo models of hypertension and cerebral vasospasm.
CAS Number
1001206-62-7
Field of Research
Cell Biology, Epigenetics & Chromatin, Metabolism Research, Pharmacology & Drug Discovery, Signal Transduction, Stem Cell & Developmental Biology
Smiles
S (C) (=O) (=O) O.S (=O) (=O) (C=1C2=C (C=CC1) C=NC=C2) N3CCCNCC3
Molecular Formula
C15H21N3O5S2
Molecular Weight
387.47
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Fasudil mesylate
CAS Number1001206-62-7
PubChem CID44602745
IUPAC Name5-(1,4-diazepan-1-ylsulfonyl)isoquinoline;methanesulfonic acid
Molecular FormulaC15H21N3O5S2
Molecular Weight387.5
Topological Polar Surface Area133
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count2
Heavy Atom Count25
Formal Charge0
Complexity513
SMILES
CS(=O)(=O)O.C1CNCCN(C1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3
InChI
InChI=1S/C14H17N3O2S.CH4O3S/c18-20(19,17-9-2-6-15-8-10-17)14-4-1-3-12-11-16-7-5-13(12)14;1-5(2,3)4/h1,3-5,7,11,15H,2,6,8-10H2;1H3,(H,2,3,4)
InChIKey
MVCDPGYHRHUECK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Fasudil mesylate
CAS: 1001206-62-7
CID: 44602745
Formula: C15H21N3O5S2
MW: 387.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight387.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count2
Exact Mass387.09226313
Monoisotopic Mass387.09226313
Topological Polar Surface Area133 Ų
Heavy Atom Count25
Formal Charge0
Complexity513
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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CatalogName
HY-10341DFasudil (mesylate)
T86411-01Fasudil mesylate
B3523-500Fasudil
HY-10341C-01Fasudil (dihydrochloride)
T3060-01Fasudil hydrochloride
1787-10Fasudil, Monohydrochloride
MBS515075-01Fasudil HCl
sc-358231AFasudil dihydrochloride
526102Hydroxy-Fasudil
AR-F01085-01Fasudil Dimer

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