CAS RN: 288262-96-4
BX471 (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.20250403 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20250314 | 10mg | In stock | Shanghai, Wuhan | Inquiry |
| Batchno.20250108 | 1g | In stock | Shanghai | Inquiry |
| Batchno.20260222 | 1mg | In stock | Shanghai, Wuhan | Inquiry |
| Batchno.20250813 | 250mg | In stock | Shanghai | Inquiry |
| Batchno.20260109 | 25mg | In stock | Shanghai | Inquiry |
| Batchno.20250708 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20260113 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS288262-96-4
- Purity/Analytical Methods: >99.0%
288262-96-4 / [5-chloro-2-[2-[(2R)-4-[(4-fluorophenyl)methyl]-2-methylpiperazin-1-yl]-2-oxoethoxy]phenyl]urea;hydrochloride
Basic Information
CAS
288262-96-4
Multi CAS
Yes
Molecular Formula
C21H25Cl2FN4O3
Molecular Weight
471.300000
Exact Mass
470.128774
InChI
InChI=1S/C21H24ClFN4O3.ClH/c1-14-11-26(12-15-2-5-17(23)6-3-15)8-9-27(14)20(28)13-30-19-7-4-16(22)10-18(19)25-21(24)29;/h2-7,10,14H,8-9,11-13H2,1H3,(H3,24,25,29);1H/t14-;/m1./s1
InChIKey
FRUCNQBAWUHKLS-PFEQFJNWSA-N
Computed Properties
Structural Parameters
Heavy atom count
31
Aromatic heavy atom count
12
Fraction Csp3
0.33
Rotatable bonds
6
H-bond acceptors
4
H-bond donors
2
Molar refractivity
120.25
TPSA
87.9
LogP / Solubility
WLOGP
3.5
MLOGP
3.12
XLogP3
3.5
Consensus LogP
3.37
Log S (ESOL)
-4.86
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.95
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.35
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.11
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
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