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CAS 1191062-85-7 5-methyl-6-morpholinopyridin-3-ylboronic acid molecular structure lightbox
CAS RN: 1191062-85-7

5-methyl-6-morpholinopyridin-3-ylboronic acid

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250606 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-019592
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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: 1g
  • Available purity: ≥97%
  • 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 1191062-85-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥97% 0 Out of Stock Beijing Inquiry

1191062-85-7 / (5-methyl-6-morpholin-4-yl-3-pyridinyl)boronic acid

(5-Methyl-6-morpholinopyridin-3-yl)boronic acid | MFCD10566507 | 5-Methyl-6-morpholinopyridine-3-boronic acid

Standard CAS: 1191062-85-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1191062-85-7
Multi CAS
Yes
Molecular Formula
C10H15BN2O3
Molecular Weight
222.050000
Exact Mass
222.117573
SMILES
B(C1=CC(=C(N=C1)N2CCOCC2)C)(O)O
InChI
InChI=1S/C10H15BN2O3/c1-8-6-9(11(14)15)7-12-10(8)13-2-4-16-5-3-13/h6-7,14-15H,2-5H2,1H3
InChIKey
PTYCDSJIQDOWIQ-UHFFFAOYSA-N
Synonyms
(5-Methyl-6-morpholinopyridin-3-yl)boronic acid MFCD10566507 5-Methyl-6-morpholinopyridine-3-boronic acid (5-methyl-6-morpholin-4-ylpyridin-3-yl)boronic acid 5-Methyl-6-morpholinopyridin-3-ylboronic acid

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
2
H-bond acceptors
5
H-bond donors
2
Molar refractivity
61.83
TPSA
65.82

LogP / Solubility

WLOGP
-1.09
MLOGP
-0.96
XLogP3
-1.09
Consensus LogP
-1.05
Log S (ESOL)
-0.67
Class (ESOL)
Very soluble
Log S (Ali)
-0.59
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.44
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.85

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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