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CAS 1000342-29-9 3H-Indazol-3-one, 7-fluoro-1,2-dihydro- molecular structure lightbox
CAS RN: 1000342-29-9

3H-Indazol-3-one, 7-fluoro-1,2-dihydro-

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260129 100mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-000145
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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 1000342-29-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Shanghai Inquiry

1000342-29-9 / 7-fluoro-1,2-dihydroindazol-3-one

7-Fluoro-1H-indazol-3-ol | 1000342-29-9 | 7-fluoro-1,2-dihydroindazol-3-one

Standard CAS: 1000342-29-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1000342-29-9
Multi CAS
Yes
Molecular Formula
C7H5FN2O
Molecular Weight
152.130000
Exact Mass
152.038591
SMILES
C1=CC2=C(C(=C1)F)NNC2=O
InChI
InChI=1S/C7H5FN2O/c8-5-3-1-2-4-6(5)9-10-7(4)11/h1-3H,(H2,9,10,11)
InChIKey
ZBFVAAYQGCHRIM-UHFFFAOYSA-N
Synonyms
7-Fluoro-1H-indazol-3-ol 1000342-29-9 7-fluoro-1,2-dihydroindazol-3-one 3-HYDROXY-7-FLUORO 1H-INDAZOLE 3-Hydroxy-7-floro 1H-indazole

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
9
H-bond acceptors
1
H-bond donors
2
Molar refractivity
38.88
TPSA
48.65

LogP / Solubility

WLOGP
1
MLOGP
0.87
XLogP3
1.3
Consensus LogP
1.06
Log S (ESOL)
-2.02
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.53
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.47
Class (SILICOS-IT)
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)
-2.94

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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