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CAS 1374651-78-1 6-broMo-5-(trifluoroMethoxy)-1H-indazole molecular structure lightbox
CAS RN: 1374651-78-1

6-broMo-5-(trifluoroMethoxy)-1H-indazole

Product Availability

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5 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250130 100mg In stock Shanghai Inquiry
Batchno.20250726 100mg / 500mg Out of stock 5-7 business days Inquiry
Batchno.20251116 1g In stock Shanghai Inquiry
Batchno.20260117 250mg In stock Shanghai Inquiry
Batchno.20250813 5g In stock Shanghai Inquiry
  • Product code: SSC-047029
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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 1374651-78-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Shenzhen Inquiry

1374651-78-1 / 6-bromo-5-(trifluoromethoxy)-1H-indazole

Standard CAS: 1374651-78-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1374651-78-1
Multi CAS
No
Molecular Formula
C8H4BrF3N2O
Molecular Weight
281.030000
Exact Mass
279.945910
SMILES
C1=C2C=NNC2=CC(=C1OC(F)(F)F)Br
InChI
InChI=1S/C8H4BrF3N2O/c9-5-2-6-4(3-13-14-6)1-7(5)15-8(10,11)12/h1-3H,(H,13,14)
InChIKey
XWGFFCNWBMBDHZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
9
Fraction Csp3
0.12
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
50.48
TPSA
37.91

LogP / Solubility

WLOGP
3.22
MLOGP
2.85
XLogP3
3.4
Consensus LogP
3.16
Log S (ESOL)
-3.99
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.19
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.28
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.15

Drug-likeness / Medicinal Chemistry

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

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