CAS RN: 91215-17-7
(4,5-DIHYDRO-THIAZOL-2-YL)-PHENETHYL-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.20250602 | 5mg / 25mg / 100mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS91215-17-7
- Purity/Analytical Methods: >99.0%
91215-17-7 / N-(2-phenylethyl)-4,5-dihydro-1,3-thiazol-2-amine
Basic Information
CAS
91215-17-7
Multi CAS
No
Molecular Formula
C11H14N2S
Molecular Weight
206.310000
Exact Mass
206.087770
InChI
InChI=1S/C11H14N2S/c1-2-4-10(5-3-1)6-7-12-11-13-8-9-14-11/h1-5H,6-9H2,(H,12,13)
InChIKey
WMGJVTLPBGGVBQ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.36
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
1
Molar refractivity
62.91
TPSA
24.39
LogP / Solubility
WLOGP
1.92
MLOGP
1.69
XLogP3
2.1
Consensus LogP
1.9
Log S (ESOL)
-2.45
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.64
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.96
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)
-2.61
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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![CAS 91215-97-3 2-[2-(DIMETHYLAMINO)ETHOXY]BENZYLAMINE 90 molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/91215-97-3.gif)
