CAS RN: 773881-43-9
N-n-Octyl-3,4-thiophenedicarboximide
Product Availability
Choose a grade to view its available package options.
5 package records5 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250822 | 200mg | In stock | Shanghai | Inquiry |
- Product code: SSC-186941
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: ≥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 |
|---|---|---|---|---|
| 1g | ≥98% | 0 Out of Stock | Beijing | Inquiry |
773881-43-9 / 5-octylthieno[3,4-c]pyrrole-4,6-dione
Basic Information
CAS
773881-43-9
Multi CAS
Yes
Molecular Formula
C14H19NO2S
Molecular Weight
265.370000
Exact Mass
265.113650
InChI
InChI=1S/C14H19NO2S/c1-2-3-4-5-6-7-8-15-13(16)11-9-18-10-12(11)14(15)17/h9-10H,2-8H2,1H3
InChIKey
QMNVUZQWXKLEFP-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
18
Aromatic heavy atom count
5
Fraction Csp3
0.57
Rotatable bonds
7
H-bond acceptors
3
Molar refractivity
73.06
TPSA
37.38
LogP / Solubility
WLOGP
3.7
MLOGP
3.27
XLogP3
4
Consensus LogP
3.66
Log S (ESOL)
-3.56
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.41
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.3
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.71
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
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![CAS 1237479-38-7 2-Ethylhexyl 4,6-Dibromo-3-fluorothieno[3,4-b]thiophene-2-carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/e1040-jpgcontextbwfzdgvyfhjvb3r8mjgzodj8aw1hz2uvanblz3xommqvagqwlzg5mza1ndaxmjyymzgvrtewndauanbnfgu5owmyoti0zgqzmjk1nda2ymyzywyxndizmjnjotaymgfjnjzmnte3mgfizti2ztmyy2myztzjotkymzhjzwi.jpeg)
