CAS RN: 207742-50-5
3,3′-Dibromo-5,5′-bis(trimethylsilyl)-2,2′-bithiophene
- Product code: SSC-097752
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: ≥98%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 5g | ≥98% | 0 Out of Stock | Shenzhen | Inquiry |
207742-50-5 / [4-bromo-5-(3-bromo-5-trimethylsilylthiophen-2-yl)thiophen-2-yl]-trimethylsilane
Basic Information
CAS
207742-50-5
Multi CAS
No
Molecular Formula
C14H20Br2S2Si2
Molecular Weight
468.400000
Exact Mass
467.889120
SMILES
C[Si](C)(C)C1=CC(=C(S1)C2=C(C=C(S2)[Si](C)(C)C)Br)Br
InChI
InChI=1S/C14H20Br2S2Si2/c1-19(2,3)11-7-9(15)13(17-11)14-10(16)8-12(18-14)20(4,5)6/h7-8H,1-6H3
InChIKey
ZKCVPMCCGPMMBH-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
20
Aromatic heavy atom count
10
Fraction Csp3
0.43
Rotatable bonds
3
H-bond acceptors
2
Molar refractivity
108.99
TPSA
56.5000
LogP / Solubility
WLOGP
6.09
MLOGP
5.39
XLogP3
6.09
Consensus LogP
5.86
Log S (ESOL)
-6.75
Class (ESOL)
Insoluble
Log S (Ali)
-7.8
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.12
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.25
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
![CAS 1160106-12-6 4,4-Di-n-octyldithieno[3,2-b:2,3-d’]silole molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
-
10-(Triethylsilyl)benzo[lmn]thieno[2,3-f][3,8]phenanthroline-1,3,6,8(2H,7H)-tetraone
- CAS RN: 2195419-19-1
- Product Code: SSC-105594
-
-
-
-
2,5-Bis[(trimethylsilyl)ethynyl]thieno[3,2-b]thiophene
- CAS RN: 139896-65-4
- Product Code: ICTB5196
- Purity/Analytical method: >98.0%(GC)
![CAS 1160106-12-6 4,4-Di-n-octyldithieno[3,2-b:2,3-d’]silole molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/d4564-jpgcontextbwfzdgvyfhjvb3r8mzyyndr8aw1hz2uvanblz3xozmmvadfilzg5mzayotyynjy3odivrdq1njquanbnfdrjngm1zjeynzi0ogizogq1mmjjyweznwvkmtnlndzjzdvjotvindbmngzmn2zlotq5zwrjnzvlymvjmzjmmte.jpeg)
![CAS 2195419-19-1 10-(Triethylsilyl)benzo[lmn]thieno[2,3-f][3,8]phenanthroline-1,3,6,8(2H,7H)-tetraone molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/t3850-jpgcontextbwfzdgvyfhjvb3r8ndmxndr8aw1hz2uvanblz3xontkvadg0lzg5mzi3mju4mtcznzqvvdm4ntauanbnfdgyywnhytblmdk2odawntmxnjm0zdbiowjjymzmyme2y2zhzge2m2uwzjvjmwnindi3ytbhmdi1mzbimjdjyzu.jpeg)
![CAS 159-68-2 9,9′-Spirobi[9H-9-silafluorene] molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/s0983-jpgcontextbwfzdgvyfhjvb3r8ntqxmjb8aw1hz2uvanblz3xonjkvagrjlzg5mziynjuyotu5mdivuza5odmuanbnfdczmdgzztg3mdfhzjdmzgy0ymm5njlkztfhmjdhnja0ndqxzdrhzjmxm2u3ytnmntnlytkyyte0ndq4njyzzgm.jpeg)
![CAS 139896-65-4 2,5-Bis[(trimethylsilyl)ethynyl]thieno[3,2-b]thiophene molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/b5196-jpgcontextbwfzdgvyfhjvb3r8mjkyndf8aw1hz2uvanblz3xontuvadrmlzg5mjkxntgxmdmwnzavqjuxotyuanbnfdvmn2iynddlmjm0yzu0odcxmti5mdjkotcwmzi5mgnkzdcwntkwy2njmmuymgiyzty1zgu0ndjkmde3n2zhogq.jpeg)