CAS RN: 1292300-75-4
TASP0415914
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.20260108 | 5mg / 10mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS1292300-75-4
- Purity/Analytical Methods: >99.0%
1292300-75-4 / N-[5-[3-(3-hydroxypiperidin-1-yl)-1,2,4-oxadiazol-5-yl]-4-methyl-1,3-thiazol-2-yl]acetamide
Basic Information
CAS
1292300-75-4
Multi CAS
No
Molecular Formula
C13H17N5O3S
Molecular Weight
323.370000
Exact Mass
323.105211
SMILES
CC1=C(SC(=N1)NC(=O)C)C2=NC(=NO2)N3CCCC(C3)O
InChI
InChI=1S/C13H17N5O3S/c1-7-10(22-13(14-7)15-8(2)19)11-16-12(17-21-11)18-5-3-4-9(20)6-18/h9,20H,3-6H2,1-2H3,(H,14,15,19)
InChIKey
WFQFHKQIDOCQTL-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
22
Aromatic heavy atom count
10
Fraction Csp3
0.54
Rotatable bonds
3
H-bond acceptors
8
H-bond donors
2
Molar refractivity
81.9
TPSA
104.38
LogP / Solubility
WLOGP
1.42
MLOGP
1.27
XLogP3
1.1
Consensus LogP
1.26
Log S (ESOL)
-2.88
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.24
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.3
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.68
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3
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