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CAS 265664-54-8 6-(DIMETHYLAMINO)-3-PYRIDINYL BORONIC ACID HYDROCHLORIDE molecular structure lightbox
CAS RN: 265664-54-8

6-(DIMETHYLAMINO)-3-PYRIDINYL BORONIC ACID HYDROCHLORIDE

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251108 1g Out of stock 8-10 business days Inquiry
  • Product code: SSC-124589
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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: 5g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 265664-54-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Shenzhen Inquiry

265664-54-8 / [6-(dimethylamino)-3-pyridinyl]boronic acid;dihydrochloride

Standard CAS: 265664-54-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
265664-54-8
Multi CAS
No
Molecular Formula
C7H13BCl2N2O2
Molecular Weight
238.910000
Exact Mass
238.044713
SMILES
B(C1=CN=C(C=C1)N(C)C)(O)O.Cl.Cl
InChI
InChI=1S/C7H11BN2O2.2ClH/c1-10(2)7-4-3-6(5-9-7)8(11)12;;/h3-5,11-12H,1-2H3;2*1H
InChIKey
RGSZPMQSHGYFCZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.29
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
2
Molar refractivity
62.89
TPSA
56.59

LogP / Solubility

WLOGP
-0.33
MLOGP
-0.28
XLogP3
-0.33
Consensus LogP
-0.31
Log S (ESOL)
-1.3
Class (ESOL)
Soluble
Log S (Ali)
-1.28
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.18
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
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)
-4.41

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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