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CAS 475094-90-7 1,2,4,5-tetrakis(imidazol-1-ylmethyl)benzene molecular structure lightbox
CAS RN: 475094-90-7

1,2,4,5-tetrakis(imidazol-1-ylmethyl)benzene

Product Availability

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5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260228 100mg In stock Shanghai Inquiry
Batchno.20250306 1g In stock Shanghai Inquiry
Batchno.20250502 250mg In stock Shanghai, Shandong Inquiry
Batchno.20250704 250mg In stock Shanghai Inquiry
Batchno.20260629 5g In stock Shanghai Inquiry
  • Product code: SSC-154473
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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: ＞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 475094-90-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Hong Kong Inquiry

475094-90-7 / 1-[[2,4,5-tris(imidazol-1-ylmethyl)phenyl]methyl]imidazole

Standard CAS: 475094-90-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
475094-90-7
Multi CAS
No
Molecular Formula
C22H22N8
Molecular Weight
398.500000
Exact Mass
398.196743
InChI
InChI=1S/C22H22N8/c1-5-27(15-23-1)11-19-9-21(13-29-7-3-25-17-29)22(14-30-8-4-26-18-30)10-20(19)12-28-6-2-24-16-28/h1-10,15-18H,11-14H2
InChIKey
YSFJZLVJLAOPGF-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
30
Aromatic heavy atom count
26
Fraction Csp3
0.18
Rotatable bonds
8
H-bond acceptors
8
Molar refractivity
111.76
TPSA
71.28

LogP / Solubility

WLOGP
2.67
MLOGP
2.37
XLogP3
0.7
Consensus LogP
1.91
Log S (ESOL)
-4.1
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.75
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.42
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.26

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5

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