CAS RN: 15200-13-2
6-ethoxy-2,3,4,5-tetrahydropyridine
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.20250707 | 250mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS15200-13-2
- Purity/Analytical Methods: >99.0%
15200-13-2 / 6-ethoxy-2,3,4,5-tetrahydropyridine
Basic Information
CAS
15200-13-2
Multi CAS
No
Molecular Formula
C7H13NO
Molecular Weight
127.180000
Exact Mass
127.099714
SMILES
CCOC1=NCCCC1
InChI
InChI=1S/C7H13NO/c1-2-9-7-5-3-4-6-8-7/h2-6H2,1H3
InChIKey
WOZDKJXZGHBIPP-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
9
Fraction Csp3
0.86
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
37.78
TPSA
21.59
LogP / Solubility
WLOGP
1.61
MLOGP
1.4
XLogP3
0.8
Consensus LogP
1.27
Log S (ESOL)
-1.57
Class (ESOL)
Soluble
Log S (Ali)
-1.76
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.94
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)
-2.36
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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