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CAS 119623-66-4 Diclofenac epolamine molecular structure lightbox
CAS RN: 119623-66-4

Diclofenac epolamine

Product Availability

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2 package records1 with current stock2 grade groups
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250617 1ml In stock Inquiry
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251103 5mg Out of stock 5-7 business days Inquiry
  • Product code: SSC-020307
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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: 0.25g
  • 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 119623-66-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Beijing Inquiry

119623-66-4 / 2-[2-(2,6-dichloroanilino)phenyl]acetic acid;2-pyrrolidin-1-ylethanol

diclofenac epolamine | Flector | DHEP

Standard CAS: 119623-66-4 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
119623-66-4
Multi CAS
Yes
Molecular Formula
C20H24Cl2N2O3
Molecular Weight
411.300000
Exact Mass
410.116398
SMILES
C1CCN(C1)CCO.C1=CC=C(C(=C1)CC(=O)O)NC2=C(C=CC=C2Cl)Cl
InChI
InChI=1S/C14H11Cl2NO2.C6H13NO/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19;8-6-5-7-3-1-2-4-7/h1-7,17H,8H2,(H,18,19);8H,1-6H2
InChIKey
DCERVXIINVUMKU-UHFFFAOYSA-N
Synonyms
diclofenac epolamine Flector DHEP Diclofenac hydroxyethylpyrrolidine Diclofenac-epolamine

Computed Properties

Structural Parameters

Heavy atom count
27
Aromatic heavy atom count
12
Fraction Csp3
0.35
Rotatable bonds
6
H-bond acceptors
4
H-bond donors
3
Molar refractivity
110.29
TPSA
72.8

LogP / Solubility

WLOGP
4.44
MLOGP
3.93
XLogP3
4.44
Consensus LogP
4.27
Log S (ESOL)
-5.12
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.14
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.74
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.08

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5

Safety & Transport

Pictogram(s)
Acute Toxic Health Hazard
Signal
Danger
GHS Hazard Statements
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral] H360D (50%): May damage the unborn child [Danger Reproductive toxicity] H412 (50%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
Precautionary Statement Codes
P203, P264, P270, P273, P280, P301+P316, P318, P321, P330, P405, and P501

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