CAS RN: 13781-37-8
2-Iodo-5-phenylthiophene
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260327 | 250mg / 1g / 5g / 25g | Out of stock | 5-7 business days | Inquiry |
- Product code: SSC-047429
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
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 | ≥97% | 0 Out of Stock | Beijing | Inquiry |
13781-37-8 / 2-iodo-5-phenylthiophene
Basic Information
CAS
13781-37-8
Multi CAS
No
Molecular Formula
C10H7IS
Molecular Weight
286.130000
Exact Mass
285.931320
SMILES
C1=CC=C(C=C1)C2=CC=C(S2)I
InChI
InChI=1S/C10H7IS/c11-10-7-6-9(12-10)8-4-2-1-3-5-8/h1-7H
InChIKey
DHRIQSGKMRCNIU-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
11
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
62.47
TPSA
28.2000
LogP / Solubility
WLOGP
4.02
MLOGP
3.55
XLogP3
3.9
Consensus LogP
3.82
Log S (ESOL)
-4.76
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.81
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.98
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.61
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
-
-
-
-
-
2-[3′-Bromo[1,1′-biphenyl]-3-yl]-4,6-diphenyl-1,3,5-triazine
- CAS RN: 1606981-69-4
- Product Code: SSC-068511
![CAS 1606981-69-4 2-[3′-Bromo[1,1′-biphenyl]-3-yl]-4,6-diphenyl-1,3,5-triazine molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/b5895-jpgcontextbwfzdgvyfhjvb3r8mzuwmzj8aw1hz2uvanblz3xozguvadkxlzg5mjkymjiynji4mtqvqju4otuuanbnfgq0yzg5yzllnjkzyjjizjjlowiznzdlzjg2mjrjmtqxmthmnje4ogm3njnkogq5ogmxmjq4yzcznwqxnge5mmy.jpeg)