1. Primary Information
| English name: | H-1152 Dihydrochloride |
| CAS No.: | 871543-07-6 |
| Molecular formula: | C16H23Cl2N3O2S |
| Molecular weight: | 392.3 g/mol |
| SMILES: | CC1CNCCCN1S(=O)(=O)C2=CC=CC3=C2C(=CN=C3)C.Cl.Cl |
| Structural class: | |
| Other identifiers: |
Coiled-Coil Kinase, rho-Associated p160 rhoA Binding Kinase ROKalpha p160 RhoA-binding kinase ROKalpha p160ROCK Protein Kinases, ROCK |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 5mg | 98% | 1840 | 2-8℃ | in stock | - |
| Kehua Intelligence | 10mg | 98% | 3200 | 2-8℃ | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
Coming soon
4. International Nomenclature & Identifiers
4.1 IUPAC Name
4-methyl-5-[[(2S)-2-methyl-1,4-diazepan-1-yl]sulfonyl]isoquinoline;dihydrochloride
4.2 InChI
InChI=1S/C16H21N3O2S.2ClH/c1-12-9-18-11-14-5-3-6-15(16(12)14)22(20,21)19-8-4-7-17-10-13(19)2;;/h3,5-6,9,11,13,17H,4,7-8,10H2,1-2H3;2*1H/t13-;;/m0../s1
4.3 InChIKey
BFOPDSJOLUQULZ-GXKRWWSZSA-N
4.4 Canonical SMILES
CC1CNCCCN1S(=O)(=O)C2=CC=CC3=C2C(=CN=C3)C.Cl.Cl
4.5 Isomeric SMILES
C[C@H]1CNCCCN1S(=O)(=O)C2=CC=CC3=C2C(=CN=C3)C.Cl.Cl
4.6 SDF file
Coming soon
5. Spectroscopic data
5.1 13C nuclear magnetic resonance (13C NMR)
5.2 1H nuclear magnetic resonance (1H NMR)
5.3 Mass spectrometry (MS)
Coming soon
5.4 Infrared spectroscopy (IR)
Coming soon
5.5 Ultraviolet/visible spectroscopy (UV/Vis)
Coming soon
-- No 3D model data available --
