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CAS 1190875-39-8 (1-(1-(Tert-Butoxycarbonyl)piperidin-4-yl)-1H-pyrazol-4-yl)boronic acid molecular structure lightbox
CAS RN: 1190875-39-8

(1-(1-(Tert-Butoxycarbonyl)piperidin-4-yl)-1H-pyrazol-4-yl)boronic acid

Product Availability

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4 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260613 1g In stock Inquiry
Batchno.20251218 250mg In stock Inquiry
Batchno.20260127 50mg In stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251004 100mg / 250mg / 1g Confirm by inquiry Shanghai 5-7 business days Inquiry
  • Product code: SSC-019542
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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: ＞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 1190875-39-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Shanghai Inquiry

1190875-39-8 / [1-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]pyrazol-4-yl]boronic acid

(1-(1-(tert-Butoxycarbonyl)piperidin-4-yl)-1H-pyrazol-4-yl)boronic acid | 1-(1-BOC-Piperidino)pyrazole-4-boronic acid | MFCD12913942

Standard CAS: 1190875-39-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1190875-39-8
Multi CAS
Yes
Molecular Formula
C13H22BN3O4
Molecular Weight
295.140000
Exact Mass
295.170336
SMILES
B(C1=CN(N=C1)C2CCN(CC2)C(=O)OC(C)(C)C)(O)O
InChI
InChI=1S/C13H22BN3O4/c1-13(2,3)21-12(18)16-6-4-11(5-7-16)17-9-10(8-15-17)14(19)20/h8-9,11,19-20H,4-7H2,1-3H3
InChIKey
BDHMWOQIBZOHFK-UHFFFAOYSA-N
Synonyms
(1-(1-(tert-Butoxycarbonyl)piperidin-4-yl)-1H-pyrazol-4-yl)boronic acid 1-(1-BOC-Piperidino)pyrazole-4-boronic acid MFCD12913942 1-(1-Boc-piperidin-4-yl)-pyrazole-4-boronic acid 1-(Boc-piperidin-4-yl)-pyrazole-4-boronate

Computed Properties

Structural Parameters

Heavy atom count
21
Aromatic heavy atom count
5
Fraction Csp3
0.69
Rotatable bonds
2
H-bond acceptors
6
H-bond donors
2
Molar refractivity
78.13
TPSA
87.82

LogP / Solubility

WLOGP
0.13
MLOGP
0.13
XLogP3
0.13
Consensus LogP
0.13
Log S (ESOL)
-1.8
Class (ESOL)
Soluble
Log S (Ali)
-2.08
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-1.93
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
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)
-4.42

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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