N-(2-Aminoethyl)isoquinoline-5-sulfonamide
Basic information
- CAS
84468-17-7- Standard SMILES
NCCNS(=O)(=O)c1cccc2cnccc12- InChIKey
DCVZSHVZGVWQKV-UHFFFAOYSA-N- Molecular formula
- C11H13N3O2S
- Average molar mass
- 251.31 g/mol
- Monoisotopic mass
- 251.07284766
Names & identifiers
- Preferred name
- N-(2-Aminoethyl)isoquinoline-5-sulfonamide
- IUPAC
- N-(2-aminoethyl)isoquinoline-5-sulfonamide
- English name
- H-9 2HCL
- Molecular formula
- C11H13N3O2S
- Molecular weight
- 251.3
Names & synonyms
N-(2-aminoethyl)isoquinoline-5-sulfonamide84468-17-7N-(2-aminoethyl)-5-isoquinolinesulfonamideAEIQSProtein kinase C inhibitor H-9DTXSID501004735N-(2-aminoethyl]-5-isoquinolinesulfonamideRefChem:926675DTXCID80199527H-9 2HCL(2-Aminoethyl)(5-isoquinolylsulfonyl)amine5-Isoquinolinesulfonamide, N-(2-aminoethyl)-
Show more names
Fasudil-Z5Aids108014Aids-108014N-(2-AMinoethyl)-5-isoquinolinesulfonic Acid AMideIsoquinoline-5-sulfonic Acid N-(2-AMinoethyl)aMideH-9 dihydrochloride,N-(2-Aminoethyl)-5-isoquinolinesulfonamidedihydrochloride
H-9CHEMBL344314H9Isoquinoline-5-sulfonic acid (2-amino-ethyl)-amideBRD7657BRD-7657H-9, DiHClIQU
Database identifiers
- CAS
84468-17-7- PubChem CID
- 3544
- DTXSID
DTXSID501004735- ChEMBL
CHEMBL344314- Nikkaji
- J360.539F
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 93.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 339
Physicochemical properties
- Melting point
- 110 · 110-112°C
- storage temp.
- 20 °C · −20°C
- solubility
- DMSO, Methanol (Sparingly)
- form
- Solid
- color
- Yellow
- WGK Germany
- 3 · 3
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
Chemistry & industry
Pharmacology
MeSH Pharmacological ClassificationAgents that inhibit PROTEIN KINASES.
Applications
UsesThe free base of H-9
Related reactions
26 records
Compound notes
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