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CAS 219583-87-6 S-3,3′-diiodo-2,2′-bis(MethoxyMethoxy)1,1′-Binaphthalene molecular structure lightbox
CAS RN: 219583-87-6

S-3,3′-diiodo-2,2′-bis(MethoxyMethoxy)1,1′-Binaphthalene

Product Availability

Choose a grade to view its available package options.

7 package records5 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251124 1g / 5g / 10g Out of stock 5-7 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250527 100g Out of stock Inquiry
Batchno.20260115 100mg In stock Shanghai, Shenzhen, Wuhan, Chengdu Inquiry
Batchno.20251028 1g In stock Shanghai Inquiry
Batchno.20250407 250mg In stock Shanghai, Tianjin, Wuhan Inquiry
Batchno.20260401 25g In stock Shanghai, Chengdu Inquiry
Batchno.20250615 5g In stock Shanghai, Shenzhen, Tianjin Inquiry
  • Product code: SSC-105604
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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: 5g
  • Available purity: ＞97%
  • 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 219583-87-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Beijing Inquiry

219583-87-6 / 3-iodo-1-[3-iodo-2-(methoxymethoxy)naphthalen-1-yl]-2-(methoxymethoxy)naphthalene

Standard CAS: 219583-87-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
219583-87-6
Multi CAS
No
Molecular Formula
C24H20I2O4
Molecular Weight
626.200000
Exact Mass
625.945100
SMILES
COCOC1=C(C2=CC=CC=C2C=C1I)C3=C(C(=CC4=CC=CC=C43)I)OCOC
InChI
InChI=1S/C24H20I2O4/c1-27-13-29-23-19(25)11-15-7-3-5-9-17(15)21(23)22-18-10-6-4-8-16(18)12-20(26)24(22)30-14-28-2/h3-12H,13-14H2,1-2H3
InChIKey
HVIYMUMYPJXEAR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
30
Aromatic heavy atom count
20
Fraction Csp3
0.17
Rotatable bonds
7
H-bond acceptors
4
Molar refractivity
137.33
TPSA
36.92

LogP / Solubility

WLOGP
6.83
MLOGP
6.07
XLogP3
7.2
Consensus LogP
6.7
Log S (ESOL)
-8.06
Class (ESOL)
Insoluble
Log S (Ali)
-9.63
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-10.24
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.69

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3

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