CAS RN: 886504-94-5
(2-METHOXY-ETHYL)-THIAZOL-2-YLMETHYL-AMINE
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.20250802 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS886504-94-5
- Purity/Analytical Methods: >99.0%
886504-94-5 / 2-methoxy-N-(1,3-thiazol-2-ylmethyl)ethanamine
Basic Information
CAS
886504-94-5
Multi CAS
Yes
Molecular Formula
C7H12N2OS
Molecular Weight
172.250000
Exact Mass
172.067034
InChI
InChI=1S/C7H12N2OS/c1-10-4-2-8-6-7-9-3-5-11-7/h3,5,8H,2,4,6H2,1H3
InChIKey
GFEZTROXAMFZOH-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
5
Fraction Csp3
0.57
Rotatable bonds
5
H-bond acceptors
4
H-bond donors
1
Molar refractivity
45.7
TPSA
34.15
LogP / Solubility
WLOGP
0.88
MLOGP
0.77
XLogP3
0.2
Consensus LogP
0.62
Log S (ESOL)
-1.47
Class (ESOL)
Soluble
Log S (Ali)
-1.61
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.11
Class (SILICOS-IT)
Moderately 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)
-3.15
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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