CAS RN: 261710-79-6
4-Thiazolecarboxaldehyde, 5-methyl-
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.20260113 | 25mg / 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS261710-79-6
- Purity/Analytical Methods: >99.0%
261710-79-6 / 5-methyl-1,3-thiazole-4-carbaldehyde
Basic Information
CAS
261710-79-6
Multi CAS
No
Molecular Formula
C5H5NOS
Molecular Weight
127.170000
Exact Mass
127.009185
InChI
InChI=1S/C5H5NOS/c1-4-5(2-7)6-3-8-4/h2-3H,1H3
InChIKey
BEVOHAAXXVHNQE-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
8
Aromatic heavy atom count
5
Fraction Csp3
0.2
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
32.24
TPSA
29.96
LogP / Solubility
WLOGP
1.26
MLOGP
1.1
XLogP3
1.1
Consensus LogP
1.15
Log S (ESOL)
-1.82
Class (ESOL)
Soluble
Log S (Ali)
-1.52
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.66
Class (SILICOS-IT)
Soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.6
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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