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CAS 1060815-72-6 2-Bromo-5-chloro-pyridin-4-ylamine molecular structure lightbox
CAS RN: 1060815-72-6

2-Bromo-5-chloro-pyridin-4-ylamine

  • Product code: SSC-007883
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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 1060815-72-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Beijing Inquiry

1060815-72-6 / 2-bromo-5-chloropyridin-4-amine

2-BROMO-5-CHLOROPYRIDIN-4-AMINE | MFCD12400754 | 4-Amino-2-bromo-5-chloropyridine

Standard CAS: 1060815-72-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1060815-72-6
Multi CAS
No
Molecular Formula
C5H4BrClN2
Molecular Weight
207.450000
Exact Mass
205.924640
SMILES
C1=C(C(=CN=C1Br)Cl)N
InChI
InChI=1S/C5H4BrClN2/c6-5-1-4(8)3(7)2-9-5/h1-2H,(H2,8,9)
InChIKey
WGAUNCHRNBJWNU-UHFFFAOYSA-N
Synonyms
2-BROMO-5-CHLOROPYRIDIN-4-AMINE MFCD12400754 4-Amino-2-bromo-5-chloropyridine SCHEMBL21246871 DTXSID70720905

Computed Properties

Structural Parameters

Heavy atom count
9
Aromatic heavy atom count
6
H-bond acceptors
2
H-bond donors
1
Molar refractivity
41.36
TPSA
38.91

LogP / Solubility

WLOGP
2.08
MLOGP
1.83
XLogP3
1.8
Consensus LogP
1.9
Log S (ESOL)
-2.93
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.76
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.73
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)
-2.51

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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