.gif)
CAS RN: 3947-76-0
1-METHYLQUINOLINIUM IODIDE
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.20250701 | 250mg / 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: SSC-147119
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: ≥95%
- 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 | ≥95% | 0 Out of Stock | Shenzhen | Inquiry |
3947-76-0 / 1-methylquinolin-1-ium iodide
Basic Information
CAS
3947-76-0
Multi CAS
No
Molecular Formula
C10H10In
Molecular Weight
271.100000
Exact Mass
270.985800
InChI
InChI=1S/C10H10N.HI/c1-11-8-4-6-9-5-2-3-7-10(9)11;/h2-8H,1H3;1H/q+1;/p-1
InChIKey
PNYRDWUKTXFTPN-UHFFFAOYSA-M
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
10
Fraction Csp3
0.1
H-bond acceptors
1
Molar refractivity
45.12
TPSA
3.88
LogP / Solubility
WLOGP
-1.33
MLOGP
-1.16
XLogP3
-1.33
Consensus LogP
-1.27
Log S (ESOL)
-1.3
Class (ESOL)
Soluble
Log S (Ali)
-0.82
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.32
Class (SILICOS-IT)
Very soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.32
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5
Customers Also Viewed
-
3-hydroxy-1-phenyl-1H-pyrazole-5-carboxylic acid
- CAS RN: 3950-18-3
- Product Code: SSC-147162
-
-
7-BROMO-1,2,3,4-TETRAHYDRO-BENZO[B]AZEPIN-5-ONE
- CAS RN: 3951-89-1
- Product Code: SSC-147177
-
-
CUPRESSUFLAVONE TRIHYDRATE
- CAS RN: 3952-18-9
- Product Code: starshine_CAS3952-18-9
- Purity/Analytical method: >99.0%
-
![CAS 3951-89-1 7-BROMO-1,2,3,4-TETRAHYDRO-BENZO[B]AZEPIN-5-ONE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/3951-89-1.gif)
