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CAS 68813-55-8 OXANTEL PAMOATE molecular structure lightbox
CAS RN: 68813-55-8

OXANTEL PAMOATE

Product Availability

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2 package records1 with current stock2 grade groups
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250915 1ml In stock Inquiry
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250119 1g / 5g Out of stock 5-7 business days Inquiry
  • Product code: SSC-178489
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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 68813-55-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

68813-55-8 / 1-[(2-carboxy-3-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid;bis(3-[(E)-2-(1-methyl-5,6-dihydro-4H-pyrimidin-2-yl)ethenyl]phenol)

Standard CAS: 68813-55-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
68813-55-8
Multi CAS
Yes
Molecular Formula
C49H48N4O8
Molecular Weight
820.900000
Exact Mass
820.347215
InChI
InChI=1S/C23H16O6.C13H16N2O/c24-20-16(14-7-3-1-5-12(14)9-18(20)22(26)27)11-17-15-8-4-2-6-13(15)10-19(21(17)25)23(28)29;1-15-9-3-8-14-13(15)7-6-11-4-2-5-12(16)10-11/h1-10,24-25H,11H2,(H,26,27)(H,28,29);2,4-7,10,16H,3,8-9H2,1H3/b;7-6+
InChIKey
CCOAINFUFGBHBA-UETGHTDLSA-N

Computed Properties

Structural Parameters

Heavy atom count
61
Aromatic heavy atom count
32
Fraction Csp3
0.18
Rotatable bonds
8
H-bond acceptors
10
H-bond donors
6
Molar refractivity
241.33
TPSA
186.72

LogP / Solubility

WLOGP
8.67
MLOGP
7.7
XLogP3
8.67
Consensus LogP
8.35
Log S (ESOL)
-10.25
Class (ESOL)
Insoluble
Log S (Ali)
-12.55
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-13.15
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.57

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
6.5

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