Cas no 127243-85-0 (H89)

H89 structure
H89 structure
Product Name:H89
CAS No:127243-85-0
MF:C20H20BrN3O2S
MW:446.360702514648
MDL:MFCD00214120
CID:162539
Update Time:2025-04-19

H89 Chemical and Physical Properties

Names and Identifiers

    • 5-Isoquinolinesulfonamide,N-[2-[[3-(4-bromophenyl)-2-propen-1-yl]amino]ethyl]-
    • H-89 dihydrochloride
    • H 89 dihydrochloride
    • H-89
    • H89 diHCl
    • N-(2-((3-(4-Bromophenyl)allyl)amino)ethyl)isoquinoline-5-sulfonamide dihydrochloride
    • N-[2-(p-Bromocinnamylamino)ethyl]-5-Isoquinoline Sulfonamide
    • H 89
    • H 89 dihydrochloride,N-[2-[[3-(4-Bromophenyl)-2-propenyl]amino]ethyl]-5-isoquinolinesulfonamidedihydrochloride
    • Protein kinase inhibitor H-89
    • N-[2-[[3-(4-Bromophenyl)-2-propen-1-yl]amino]ethyl]-5-isoquinolinesulfonamide
    • H-89 hcl
    • H-89 & H-89 2HCl
    • H-89 HYDROCHLORIDE
    • N-[2-[P-BROMOCINNAMYLAMINO]-ETHYL]-5-ISOQUINOLINESULFONMIDE
    • N-[2-(4-bromocinnamylamino)ethyl]isoquinoline-5-sulfonamide
    • H-89 dihydrochloride,98%
    • H-89, Dihydrochloride Salt >99%
    • N-(2-(4-Bromocinnamylamino)ethyl)-5-isoquinolinesulfonamide
    • N-[2-[[(E)-3-(4-bromophenyl)prop-2-enyl]amino]ethyl]isoquinoline-5-sulfonamide
    • N-(2-{[3-(4-bromophenyl)prop-2-en-1-yl]amino}ethyl)isoquinoline-5-sulfonamide
    • N-(2-{[(2E)-3-(4-bromophenyl)prop-2-en-1-yl]amino}ethyl)isoquinoline-5-sulfonamide
    • H89
    • M876330O56
    • 5-Isoquinolinesulfonamide, N-(2-((3-(4-bromophenyl)-2-propenyl)amino)ethy
    • MDL: MFCD00214120
    • Inchi: 1S/C20H20BrN3O2S/c21-18-8-6-16(7-9-18)3-2-11-22-13-14-24-27(25,26)20-5-1-4-17-15-23-12-10-19(17)20/h1-10,12,15,22,24H,11,13-14H2/b3-2+
    • InChI Key: ZKZXNDJNWUTGDK-NSCUHMNNSA-N
    • SMILES: BrC1C=CC(=CC=1)/C=C/CNCCNS(C1=CC=CC2C=NC=CC1=2)(=O)=O

Computed Properties

  • Exact Mass: 445.04600
  • Monoisotopic Mass: 445.04596 g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 27
  • Rotatable Bond Count: 8
  • Complexity: 570
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • XLogP3: 3.5
  • Topological Polar Surface Area: 79.5
  • Molecular Weight: 446.4

Experimental Properties

  • Color/Form: Off white powder
  • Density: 1.436
  • Melting Point: 195-200°C
  • Solubility: H2O: ≥10?mg/mL
  • PSA: 79.47000
  • LogP: 5.44120
  • Solubility: Soluble in water, >10mg/ml

H89 Security Information

  • WGK Germany:3
  • Safety Instruction: S22-S24/25
  • Storage Condition:Please store the product under the recommended conditions in the Certificate of Analysis.

H89 Customs Data

  • HS CODE:29350090

H89 Pricemore >>

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