CAS RN: 1956426-56-4
KN93 hydrochloride
Product Availability
Choose a grade to view its available package options.
8 package records8 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250325 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20260528 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20260312 | 1g | In stock | Shanghai | Inquiry |
| Batchno.20260408 | 1mg | In stock | Shanghai | Inquiry |
| Batchno.20260121 | 250mg | In stock | Shanghai | Inquiry |
| Batchno.20251123 | 25mg | In stock | Shanghai | Inquiry |
| Batchno.20260221 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20250619 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS1956426-56-4
- Purity/Analytical Methods: >99.0%
1956426-56-4 / N-[2-[[[(E)-3-(4-chlorophenyl)prop-2-enyl]-methylamino]methyl]phenyl]-N-(2-hydroxyethyl)-4-methoxybenzenesulfonamide;hydrochloride
Basic Information
CAS
1956426-56-4
Multi CAS
No
Molecular Formula
C26H30Cl2N2O4S
Molecular Weight
537.500000
Exact Mass
536.130334
SMILES
CN(C/C=C/C1=CC=C(C=C1)Cl)CC2=CC=CC=C2N(CCO)S(=O)(=O)C3=CC=C(C=C3)OC.Cl
InChI
InChI=1S/C26H29ClN2O4S.ClH/c1-28(17-5-6-21-9-11-23(27)12-10-21)20-22-7-3-4-8-26(22)29(18-19-30)34(31,32)25-15-13-24(33-2)14-16-25;/h3-16,30H,17-20H2,1-2H3;1H/b6-5+;
InChIKey
ATHMCQDBXQEIOK-IPZCTEOASA-N
Computed Properties
Structural Parameters
Heavy atom count
35
Aromatic heavy atom count
18
Fraction Csp3
0.23
Rotatable bonds
11
H-bond acceptors
5
H-bond donors
1
Molar refractivity
145.12
TPSA
70.08
LogP / Solubility
WLOGP
5.1
MLOGP
4.53
XLogP3
5.1
Consensus LogP
4.91
Log S (ESOL)
-6.04
Class (ESOL)
Insoluble
Log S (Ali)
-7.65
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.71
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.38
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
No
Egan
Yes
Muegge
No
Bioavailability score
0.56
Leadlikeness
No
Synthetic Accessibility
2.5
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