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CAS 1432754-20-5 1-(3-bromo-5-chloropyridin-2-yl)ethanamine hydrochloride molecular structure lightbox
CAS RN: 1432754-20-5

1-(3-bromo-5-chloropyridin-2-yl)ethanamine hydrochloride

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250514 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-054674
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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: 0.25g
  • 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 1432754-20-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Beijing Inquiry

1432754-20-5 / 1-(3-bromo-5-chloro-2-pyridinyl)ethanamine;hydrochloride

Standard CAS: 1432754-20-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1432754-20-5
Multi CAS
No
Molecular Formula
C7H9BrCl2N2
Molecular Weight
271.970000
Exact Mass
269.932620
SMILES
CC(C1=C(C=C(C=N1)Cl)Br)N.Cl
InChI
InChI=1S/C7H8BrClN2.ClH/c1-4(10)7-6(8)2-5(9)3-11-7;/h2-4H,10H2,1H3;1H
InChIKey
ZZMXSANBFIRPSJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.29
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
56.8
TPSA
38.91

LogP / Solubility

WLOGP
2.94
MLOGP
2.59
XLogP3
2.94
Consensus LogP
2.82
Log S (ESOL)
-3.68
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.91
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.99
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.29

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2

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