CAS RN: 454705-62-5
4-Chloro-6-(Methylsulfonyl)quinoline
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.20250503 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-153204
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: ＞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 |
|---|---|---|---|---|
| 1g | ＞97% | 0 Out of Stock | Shenzhen | Inquiry |
454705-62-5 / 4-chloro-6-methylsulfonylquinoline
Basic Information
CAS
454705-62-5
Multi CAS
No
Molecular Formula
C10H8CLNO2S
Molecular Weight
241.690000
Exact Mass
240.996427
InChI
InChI=1S/C10H8ClNO2S/c1-15(13,14)7-2-3-10-8(6-7)9(11)4-5-12-10/h2-6H,1H3
InChIKey
KJVKESYMVCSYLW-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
10
Fraction Csp3
0.1
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
59.86
TPSA
47.03
LogP / Solubility
WLOGP
2.29
MLOGP
2.02
XLogP3
2.1
Consensus LogP
2.14
Log S (ESOL)
-3.21
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.2
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.25
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.57
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
Carbamic acid, (4-methyl-3-piperidinyl)-, 1,1-dimethylethyl ester (9CI)
- CAS RN: 454709-84-3
- Product Code: SSC-153205
-
1-Piperidinecarboxylic acid, 3-aMino-4-hydroxy-, 1,1-diMethylethyl ester
- CAS RN: 454709-92-3
- Product Code: SSC-153206
-
Carbamic acid, [(1R,2R)-2-aminocyclobutyl]-, 1,1-dimethylethyl ester, rel- (9CI)
- CAS RN: 454709-94-5
- Product Code: SSC-153207
-
Carbamic acid, [(2S)-2-(methylamino)propyl]-, 1,1-dimethylethyl ester (9CI)
- CAS RN: 454709-95-6
- Product Code: SSC-153208
-
Carbamic acid, [(2R)-2-(methylamino)propyl]-, 1,1-dimethylethyl ester (9CI)
- CAS RN: 454709-96-7
- Product Code: starshine_CAS454709-96-7
- Purity/Analytical method: >99.0%
-
Carbamic acid, [(1R,3S)-3-aminocyclopentyl]-, 1,1-dimethylethyl ester, rel-
- CAS RN: 454709-98-9
- Product Code: SSC-153209
![CAS 454709-94-5 Carbamic acid, [(1R,2R)-2-aminocyclobutyl]-, 1,1-dimethylethyl ester, rel- (9CI) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/454709-94-5.gif)
![CAS 454709-95-6 Carbamic acid, [(2S)-2-(methylamino)propyl]-, 1,1-dimethylethyl ester (9CI) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/454709-95-6.gif)
![CAS 454709-96-7 Carbamic acid, [(2R)-2-(methylamino)propyl]-, 1,1-dimethylethyl ester (9CI) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/454709-96-7.gif)
![CAS 454709-98-9 Carbamic acid, [(1R,3S)-3-aminocyclopentyl]-, 1,1-dimethylethyl ester, rel- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/454709-98-9.gif)