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CAS 365547-21-3 2,6-Dibromo-4,4-bis(2-ethylhexyl)-4H-cyclopenta[2,1-b:3,4-b’]dithiophene molecular structure lightbox
CAS RN: 365547-21-3

2,6-Dibromo-4,4-bis(2-ethylhexyl)-4H-cyclopenta[2,1-b:3,4-b’]dithiophene

Product Availability

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7 package records6 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250128 1g In stock Inquiry
Batchno.20260505 200mg In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260427 100mg In stock Shanghai, Shenzhen, Wuhan, Chengdu Inquiry
Batchno.20260501 1g In stock Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20251206 250mg In stock Chengdu Inquiry
Batchno.20260621 5g Out of stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250708 100mg In stock Shanghai Inquiry
  • Product code: SSC-143744
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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: ≥99%
  • 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 365547-21-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥99% 0 Out of Stock Shenzhen Inquiry

365547-21-3 / 4,10-dibromo-7,7-bis(2-ethylhexyl)-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene

Standard CAS: 365547-21-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
365547-21-3
Multi CAS
No
Molecular Formula
C25H36BR2S2
Molecular Weight
560.500000
Exact Mass
560.060470
InChI
InChI=1S/C25H36Br2S2/c1-5-9-11-17(7-3)15-25(16-18(8-4)12-10-6-2)19-13-21(26)28-23(19)24-20(25)14-22(27)29-24/h13-14,17-18H,5-12,15-16H2,1-4H3
InChIKey
NEQRAFHWWLGKEJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
29
Aromatic heavy atom count
10
Fraction Csp3
0.68
Rotatable bonds
12
H-bond acceptors
2
Molar refractivity
139.66
TPSA
56.5000

LogP / Solubility

WLOGP
10.81
MLOGP
9.56
XLogP3
12.9
Consensus LogP
11.09
Log S (ESOL)
-9.59
Class (ESOL)
Insoluble
Log S (Ali)
-11.96
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-13.72
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)
1.54

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
3.5

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