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CAS 38771-76-5 1,3-Dibromotriazine molecular structure lightbox
CAS RN: 38771-76-5

1,3-Dibromotriazine

  • Product code: SSC-146378
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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 38771-76-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

38771-76-5 / 2,4-dibromo-1,3,5-triazine

Standard CAS: 38771-76-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
38771-76-5
Multi CAS
Yes
Molecular Formula
C3HBR2N3
Molecular Weight
238.870000
Exact Mass
238.851670
InChI
InChI=1S/C3HBr2N3/c4-2-6-1-7-3(5)8-2/h1H
InChIKey
XGHDYDDFXRLPLQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
8
Aromatic heavy atom count
6
H-bond acceptors
3
Molar refractivity
35.23
TPSA
38.67

LogP / Solubility

WLOGP
1.4
MLOGP
1.23
XLogP3
2
Consensus LogP
1.54
Log S (ESOL)
-2.76
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.53
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.37
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)
-3.19

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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