![CAS 2154343-28-7 3-(6-chloro-1-oxo-1,3-dihydro-2H-pyrrolo[3,4-c]pyridin-2-yl)piperidine-2,6-dione molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2154343-28-7.png)
CAS RN: 2154343-28-7
3-(6-chloro-1-oxo-1,3-dihydro-2H-pyrrolo[3,4-c]pyridin-2-yl)piperidine-2,6-dione
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250629 | 100mg / 250mg | Confirm by inquiry | Shanghai | Inquiry |
- Product code: SSC-103239
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 | Shanghai | Inquiry |
2154343-28-7 / 3-(6-chloro-1-oxo-3H-pyrrolo[3,4-c]pyridin-2-yl)piperidine-2,6-dione
Basic Information
CAS
2154343-28-7
Multi CAS
No
Molecular Formula
C12H10ClN3O3
Molecular Weight
279.680000
Exact Mass
279.041069
SMILES
C1CC(=O)NC(=O)C1N2CC3=CN=C(C=C3C2=O)Cl
InChI
InChI=1S/C12H10ClN3O3/c13-9-3-7-6(4-14-9)5-16(12(7)19)8-1-2-10(17)15-11(8)18/h3-4,8H,1-2,5H2,(H,15,17,18)
InChIKey
NRAAAIFIZSDUEI-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
19
Aromatic heavy atom count
6
Fraction Csp3
0.33
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
1
Molar refractivity
65.29
TPSA
79.37
LogP / Solubility
WLOGP
0.5
MLOGP
0.45
XLogP3
0.1
Consensus LogP
0.35
Log S (ESOL)
-2.05
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.21
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.01
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
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)
-4.07
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2
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![CAS 2154357-70-5 4-chloro-2-(2,6-dioxopiperidin-3-yl)-1H-pyrrolo[3,4-c]pyridine-1,3(2H)-dione molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2154357-70-5.png)
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