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CAS 264122-82-9 2-Pyrrolidinone, 4-(4-Fluorophenyl) molecular structure lightbox
CAS RN: 264122-82-9

2-Pyrrolidinone, 4-(4-Fluorophenyl)

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251008 100mg / 250mg / 1g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-124025
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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 264122-82-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

264122-82-9 / 4-(4-fluorophenyl)pyrrolidin-2-one

Standard CAS: 264122-82-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
264122-82-9
Multi CAS
No
Molecular Formula
C10H10FNO
Molecular Weight
179.190000
Exact Mass
179.074642
SMILES
C1C(CNC1=O)C2=CC=C(C=C2)F
InChI
InChI=1S/C10H10FNO/c11-9-3-1-7(2-4-9)8-5-10(13)12-6-8/h1-4,8H,5-6H2,(H,12,13)
InChIKey
JIQYWLZCHCBUSG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.3
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
46.77
TPSA
29.1

LogP / Solubility

WLOGP
1.43
MLOGP
1.26
XLogP3
1.1
Consensus LogP
1.26
Log S (ESOL)
-2.13
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.06
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.13
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)
-2.8

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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