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CAS 1001397-43-8 4-BroMo-piperidine hydrochloride molecular structure lightbox
CAS RN: 1001397-43-8

4-BroMo-piperidine hydrochloride

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250424 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-000529
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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: ≥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 1001397-43-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

1001397-43-8 / 4-bromopiperidine;hydrochloride

4-Bromopiperidine hydrochloride | 4-Bromo-piperidine hydrochloride | 4-bromopiperidine;hydrochloride

Standard CAS: 1001397-43-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1001397-43-8
Multi CAS
No
Molecular Formula
C5H11BrClN
Molecular Weight
200.500000
Exact Mass
198.976340
SMILES
C1CNCCC1Br.Cl
InChI
InChI=1S/C5H10BrN.ClH/c6-5-1-3-7-4-2-5;/h5,7H,1-4H2;1H
InChIKey
VSPDXGMFJVJBAH-UHFFFAOYSA-N
Synonyms
4-Bromopiperidine hydrochloride 4-Bromo-piperidine hydrochloride 4-bromopiperidine;hydrochloride Piperidine, 4-bromo-, hydrochloride (1:1) MFCD21098324

Computed Properties

Structural Parameters

Heavy atom count
8
Fraction Csp3
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
42.07
TPSA
12.03

LogP / Solubility

WLOGP
1.56
MLOGP
1.37
XLogP3
1.56
Consensus LogP
1.5
Log S (ESOL)
-2.06
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.33
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.25
Class (SILICOS-IT)
Moderately 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)
-2.84

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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