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CAS 5848-05-5 4-(4-FLUOROPHENYL)-1H-PYRAZOL-5-AMINE molecular structure lightbox
CAS RN: 5848-05-5

4-(4-FLUOROPHENYL)-1H-PYRAZOL-5-AMINE

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250924 250mg / 1g / 5g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS5848-05-5
  • Purity/Analytical Methods: >99.0%
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5848-05-5 / 4-(4-fluorophenyl)-1H-pyrazol-5-amine

Standard CAS: 5848-05-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
5848-05-5
Multi CAS
Yes
Molecular Formula
C9FH8N3
Molecular Weight
177.180000
Exact Mass
177.070225
InChI
InChI=1S/C9H8FN3/c10-7-3-1-6(2-4-7)8-5-12-13-9(8)11/h1-5H,(H3,11,12,13)
InChIKey
SIXWIUJQBBANGK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
11
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
48.39
TPSA
54.7

LogP / Solubility

WLOGP
1.8
MLOGP
1.58
XLogP3
1.6
Consensus LogP
1.66
Log S (ESOL)
-2.63
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.31
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.42
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)
-2.52

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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