CAS RN: 29926-42-9
2-PROPIONYL-2-THIAZOLINE
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.20250519 | 200mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS29926-42-9
- Purity/Analytical Methods: >99.0%
29926-42-9 / 1-(4,5-dihydro-1,3-thiazol-2-yl)propan-1-one
Basic Information
CAS
29926-42-9
Multi CAS
No
Molecular Formula
C6H9NOS
Molecular Weight
143.210000
Exact Mass
143.040485
InChI
InChI=1S/C6H9NOS/c1-2-5(8)6-7-3-4-9-6/h2-4H2,1H3
InChIKey
MFQABLFJUQNPAC-UHFFFAOYSA-N
Physical Properties
Density
1.230-1.245
Physical Description
Colourless to light yllow liquid; Meaty, nutty, cooked, brown roasted aroma
State
Liquid
Computed Properties
Structural Parameters
Heavy atom count
9
Fraction Csp3
0.67
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
40.06
TPSA
29.43
LogP / Solubility
WLOGP
1.11
MLOGP
0.97
XLogP3
0.7
Consensus LogP
0.93
Log S (ESOL)
-1.3
Class (ESOL)
Soluble
Log S (Ali)
-1.54
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.75
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)
-2.8
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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