![CAS 2304635-01-4 {5-fluoro-1-[tris(propan-2-yl)silyl]-1H-indol-4-yl}boronic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB83121700.gif)
CAS RN: 2304635-01-4
{5-fluoro-1-[tris(propan-2-yl)silyl]-1H-indol-4-yl}boronic acid
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250731 | 100mg / 500mg | Out of stock | 15 business days | Inquiry |
- Product code: SSC-111926
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 1g
- Available purity: ≥95%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥95% | 0 Out of Stock | Hong Kong | Inquiry |
2304635-01-4 / [5-fluoro-1-tri(propan-2-yl)silylindol-4-yl]boronic acid
Basic Information
CAS
2304635-01-4
Multi CAS
No
Molecular Formula
C17H27BFNO2Si
Molecular Weight
335.300000
Exact Mass
335.188814
SMILES
B(C1=C(C=CC2=C1C=CN2[Si](C(C)C)(C(C)C)C(C)C)F)(O)O
InChI
InChI=1S/C17H27BFNO2Si/c1-11(2)23(12(3)4,13(5)6)20-10-9-14-16(20)8-7-15(19)17(14)18(21)22/h7-13,21-22H,1-6H3
InChIKey
ZKSPJZIANXXTCN-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
23
Aromatic heavy atom count
9
Fraction Csp3
0.53
Rotatable bonds
5
H-bond acceptors
3
H-bond donors
2
Molar refractivity
98.17
TPSA
45.39
LogP / Solubility
WLOGP
3.48
MLOGP
3.08
XLogP3
3.48
Consensus LogP
3.35
Log S (ESOL)
-4.07
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.82
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.33
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.29
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2.5
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