CAS RN: 86445-22-9
Auxinole
Product Availability
Choose a grade to view its available package options.
15 package records13 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250629 | 100mg | Out of stock | 5-7 business days | Inquiry | |
| Batchno.20251105 | 100mg | In stock | Shanghai, Tianjin, Wuhan | Inquiry | |
| Batchno.20260618 | 10mg | In stock | Shanghai | Inquiry | |
| Batchno.20250304 | 1g | Out of stock | Inquiry | ||
| Batchno.20250520 | 250mg | In stock | Shanghai, Tianjin, Wuhan | Inquiry | |
| Batchno.20251230 | 25mg | In stock | Shanghai | Inquiry | |
| Batchno.20260503 | 25mg | In stock | Shanghai | Inquiry | |
| Batchno.20250518 | 50mg | In stock | Shanghai, Tianjin, Wuhan | Inquiry | |
| Batchno.20250108 | 5mg | In stock | Shanghai, Shandong | Inquiry |
- Product code: starshine_CAS86445-22-9
- Purity/Analytical Methods: >99.0%
86445-22-9 / 4-(2,4-dimethylphenyl)-2-(1H-indol-3-yl)-4-oxobutanoic acid
Basic Information
CAS
86445-22-9
Multi CAS
No
Molecular Formula
C20H19NO3
Molecular Weight
321.400000
Exact Mass
321.136493
InChI
InChI=1S/C20H19NO3/c1-12-7-8-14(13(2)9-12)19(22)10-16(20(23)24)17-11-21-18-6-4-3-5-15(17)18/h3-9,11,16,21H,10H2,1-2H3,(H,23,24)
InChIKey
HGUYAIJBXSQXGV-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
24
Aromatic heavy atom count
15
Fraction Csp3
0.2
Rotatable bonds
5
H-bond acceptors
2
H-bond donors
2
Molar refractivity
93.54
TPSA
70.16
LogP / Solubility
WLOGP
4.23
MLOGP
3.73
XLogP3
3.6
Consensus LogP
3.85
Log S (ESOL)
-4.63
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.25
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.86
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.68
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
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