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CAS 1211589-28-4 (3-Bromo-6-chloropyridin-2-yl)methanamine molecular structure lightbox
CAS RN: 1211589-28-4

(3-Bromo-6-chloropyridin-2-yl)methanamine

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250504 100mg / 250mg Out of stock 15 business days Inquiry
  • Product code: SSC-022869
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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 1211589-28-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

1211589-28-4 / (3-bromo-6-chloro-2-pyridinyl)methanamine

(3-BROMO-6-CHLOROPYRIDIN-2-YL)METHANAMINE | MFCD18250472 | SCHEMBL25295311

Standard CAS: 1211589-28-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1211589-28-4
Multi CAS
No
Molecular Formula
C6H6BrClN2
Molecular Weight
221.480000
Exact Mass
219.940290
SMILES
C1=CC(=NC(=C1Br)CN)Cl
InChI
InChI=1S/C6H6BrClN2/c7-4-1-2-6(8)10-5(4)3-9/h1-2H,3,9H2
InChIKey
YTHRNMAFBYGWGU-UHFFFAOYSA-N
Synonyms
(3-BROMO-6-CHLOROPYRIDIN-2-YL)METHANAMINE MFCD18250472 SCHEMBL25295311 SCHEMBL30381289 AB73060

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
Fraction Csp3
0.17
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
44.84
TPSA
38.91

LogP / Solubility

WLOGP
1.96
MLOGP
1.72
XLogP3
1.4
Consensus LogP
1.69
Log S (ESOL)
-2.82
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.79
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.84
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)
-2.68

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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