![CAS 934541-31-8 5-[3-(Ethylsulfonyl)phenyl]-3,8-dimethyl-N-(1-methyl-4-piperidinyl)-9H-pyrido[2,3-b]indole-7-carboxamide molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/934541-31-8.gif)
CAS RN: 934541-31-8
5-[3-(Ethylsulfonyl)phenyl]-3,8-dimethyl-N-(1-methyl-4-piperidinyl)-9H-pyrido[2,3-b]indole-7-carboxamide
Product Availability
Choose a grade to view its available package options.
6 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250821 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20260108 | 1mg | In stock | Shanghai, Shandong | Inquiry |
| Batchno.20250328 | 25mg | Out of stock | Inquiry | |
| Batchno.20260121 | 50mg | Out of stock | Inquiry | |
| Batchno.20260110 | 5mg | In stock | Shanghai | Inquiry |
| Batchno.20260531 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS934541-31-8
- Purity/Analytical Methods: >99.0%
934541-31-8 / 5-(3-ethylsulfonylphenyl)-3,8-dimethyl-N-(1-methylpiperidin-4-yl)-9H-pyrido[2,3-b]indole-7-carboxamide
Basic Information
CAS
934541-31-8
Multi CAS
Yes
Molecular Formula
C28H32N4O3S
Molecular Weight
504.600000
Exact Mass
504.219512
InChI
InChI=1S/C28H32N4O3S/c1-5-36(34,35)21-8-6-7-19(14-21)23-15-22(28(33)30-20-9-11-32(4)12-10-20)18(3)26-25(23)24-13-17(2)16-29-27(24)31-26/h6-8,13-16,20H,5,9-12H2,1-4H3,(H,29,31)(H,30,33)
InChIKey
WKDACQVEJIVHMZ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
36
Aromatic heavy atom count
19
Fraction Csp3
0.36
Rotatable bonds
5
H-bond acceptors
5
H-bond donors
2
Molar refractivity
144.22
TPSA
95.16
LogP / Solubility
WLOGP
4.62
MLOGP
4.1
XLogP3
4.5
Consensus LogP
4.41
Log S (ESOL)
-5.94
Class (ESOL)
Slightly soluble
Log S (Ali)
-7.03
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.37
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.52
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
5
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