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CAS 358727-55-6 2,4-Bis[8-hydroxy-1,1,7,7-tetramethyljulolidin-9-yl]squaraine molecular structure lightbox
CAS RN: 358727-55-6

2,4-Bis[8-hydroxy-1,1,7,7-tetramethyljulolidin-9-yl]squaraine

Product Availability

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6 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260129 100mg In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260117 10g Out of stock Inquiry
Batchno.20250906 1g In stock Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250921 200mg / 1g / 5g Confirm by inquiry Shanghai 8-10 business days Inquiry
Batchno.20260619 250mg In stock Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250513 5g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
  • Product code: SSC-142943
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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 358727-55-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Shenzhen Inquiry

358727-55-6 / 7-[2-hydroxy-3-(6-hydroxy-4,4,10,10-tetramethyl-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-yl)-4-oxocyclobut-2-en-1-ylidene]-4,4,10,10-tetramethyl-1-azatricyclo[7.3.1.05,13]trideca-5(13),8-dien-6-one

Standard CAS: 358727-55-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
358727-55-6
Multi CAS
Yes
Molecular Formula
C36H44N2O4
Molecular Weight
568.700000
Exact Mass
568.330108
InChI
InChI=1S/C36H44N2O4/c1-33(2)9-13-37-15-11-35(5,6)25-27(37)21(33)17-19(29(25)39)23-31(41)24(32(23)42)20-18-22-28-26(30(20)40)36(7,8)12-16-38(28)14-10-34(22,3)4/h17-18,39,41H,9-16H2,1-8H3
InChIKey
UACUNHLYBGUYBK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
42
Aromatic heavy atom count
6
Fraction Csp3
0.56
Rotatable bonds
1
H-bond acceptors
6
H-bond donors
2
Molar refractivity
165.67
TPSA
81.08

LogP / Solubility

WLOGP
6.63
MLOGP
5.88
XLogP3
6.6
Consensus LogP
6.37
Log S (ESOL)
-7.59
Class (ESOL)
Insoluble
Log S (Ali)
-9.01
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.98
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.48

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
6

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