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CAS 229009-40-9 4-(4-Methylpiperazin-1-yl)phenylboronic Acid molecular structure lightbox
CAS RN: 229009-40-9

4-(4-Methylpiperazin-1-yl)phenylboronic Acid

Product Availability

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4 package records3 with current stock2 grade groups
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260107 1g In stock Inquiry
Batchno.20250120 250mg In stock Inquiry
Batchno.20250118 5g In stock Inquiry
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250905 250mg / 1g / 5g / 10g / 25g Out of stock 8-10 business days Inquiry
  • Product code: SSC-111459
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.25g, 1g, 25g, 5g, 10g
  • Available purity: ≥95%
  • Inventory rows with stock: 3
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 229009-40-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 5 In Stock Hong Kong Inquiry
1g ≥95% 4 In Stock Hong Kong Inquiry
25g ≥95% 1 In Stock Hong Kong Inquiry
5g ≥95% 0 Out of Stock Shenzhen Inquiry
10g ≥95% 0 Out of Stock Hong Kong Inquiry

229009-40-9 / [4-(4-methylpiperazin-1-yl)phenyl]boronic acid

Standard CAS: 229009-40-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
229009-40-9
Multi CAS
No
Molecular Formula
C11H17BN2O2
Molecular Weight
220.080000
Exact Mass
220.138308
SMILES
B(C1=CC=C(C=C1)N2CCN(CC2)C)(O)O
InChI
InChI=1S/C11H17BN2O2/c1-13-6-8-14(9-7-13)11-4-2-10(3-5-11)12(15)16/h2-5,15-16H,6-9H2,1H3
InChIKey
LSKYURVDOIDSCG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
6
Fraction Csp3
0.45
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
2
Molar refractivity
65.98
TPSA
46.94

LogP / Solubility

WLOGP
-0.88
MLOGP
-0.77
XLogP3
-0.88
Consensus LogP
-0.84
Log S (ESOL)
-0.79
Class (ESOL)
Very soluble
Log S (Ali)
-0.73
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.6
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
Low
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.69

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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