CAS RN: 847163-28-4
ML 351
Product Availability
Choose a grade to view its available package options.
6 package records6 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260305 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20250729 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20260108 | 10mg / 25mg | Confirm by inquiry | Shanghai | Inquiry |
| Batchno.20250112 | 250mg | In stock | Shanghai | Inquiry |
| Batchno.20260105 | 25mg | In stock | Shanghai | Inquiry |
| Batchno.20250129 | 50mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS847163-28-4
- Purity/Analytical Methods: >99.0%
847163-28-4 / 5-(methylamino)-2-naphthalen-1-yl-1,3-oxazole-4-carbonitrile
Basic Information
CAS
847163-28-4
Multi CAS
Yes
Molecular Formula
C15H11N3O
Molecular Weight
249.270000
Exact Mass
249.090212
InChI
InChI=1S/C15H11N3O/c1-17-15-13(9-16)18-14(19-15)12-8-4-6-10-5-2-3-7-11(10)12/h2-8,17H,1H3
InChIKey
DYXYXTDIFMDJIR-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
19
Aromatic heavy atom count
15
Fraction Csp3
0.07
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
73.71
TPSA
61.85
LogP / Solubility
WLOGP
3.41
MLOGP
3.01
XLogP3
4.2
Consensus LogP
3.54
Log S (ESOL)
-3.98
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.06
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.35
Class (SILICOS-IT)
Slightly 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)
-1.82
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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