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CAS 1167056-02-1 5-Fluoro-7-nitro 1H-indazole molecular structure lightbox
CAS RN: 1167056-02-1

5-Fluoro-7-nitro 1H-indazole

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250701 50mg / 100mg / 250mg Out of stock 5-7 business days Inquiry
  • Product code: SSC-016646
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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 1167056-02-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

1167056-02-1 / 5-fluoro-7-nitro-1H-indazole

5-fluoro-7-nitro-1H-indazole | 5-Fluoro-7-nitro 1H-indazole | 1H-Indazole, 5-fluoro-7-nitro-

Standard CAS: 1167056-02-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1167056-02-1
Multi CAS
No
Molecular Formula
C7H4FN3O2
Molecular Weight
181.120000
Exact Mass
181.028755
SMILES
C1=C(C=C(C2=C1C=NN2)[N+](=O)[O-])F
InChI
InChI=1S/C7H4FN3O2/c8-5-1-4-3-9-10-7(4)6(2-5)11(12)13/h1-3H,(H,9,10)
InChIKey
UEKZIDSQISFLMJ-UHFFFAOYSA-N
Synonyms
5-fluoro-7-nitro-1H-indazole 5-Fluoro-7-nitro 1H-indazole 1H-Indazole, 5-fluoro-7-nitro- MFCD12405194 AKOS027253671

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
9
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
42.71
TPSA
71.82

LogP / Solubility

WLOGP
1.61
MLOGP
1.41
XLogP3
1.9
Consensus LogP
1.64
Log S (ESOL)
-2.42
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.21
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.29
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
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
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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