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CAS 348-19-6 2′-FLUORO-4′-NITROACETANILID molecular structure lightbox
CAS RN: 348-19-6

2′-FLUORO-4′-NITROACETANILID

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1 package records0 with current stock
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260110 5mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS348-19-6
  • Purity/Analytical Methods: >99.0%
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348-19-6 / N-(2-fluoro-4-nitrophenyl)acetamide

Standard CAS: 348-19-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
348-19-6
Multi CAS
No
Molecular Formula
C8FH7N2O3
Molecular Weight
198.150000
Exact Mass
198.044070
InChI
InChI=1S/C8H7FN2O3/c1-5(12)10-8-3-2-6(11(13)14)4-7(8)9/h2-4H,1H3,(H,10,12)
InChIKey
KFSFGCHQQCRZBB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.12
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
47.36
TPSA
72.24

LogP / Solubility

WLOGP
1.69
MLOGP
1.49
XLogP3
1.1
Consensus LogP
1.43
Log S (ESOL)
-2.32
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.41
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.59
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)
-2.73

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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