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CAS RN: 368866-12-0
4-(AMINO-METHOXYCARBONYL-METHYL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
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.20251105 | 100mg / 250mg / 500mg | Out of stock | 1 business days | Inquiry |
- Product code: starshine_CAS368866-12-0
- Purity/Analytical Methods: >99.0%
368866-12-0 / tert-butyl 4-(1-amino-2-methoxy-2-oxoethyl)piperidine-1-carboxylate
Basic Information
CAS
368866-12-0
Multi CAS
Yes
Molecular Formula
C13H24N2O4
Molecular Weight
272.340000
Exact Mass
272.173607
InChI
InChI=1S/C13H24N2O4/c1-13(2,3)19-12(17)15-7-5-9(6-8-15)10(14)11(16)18-4/h9-10H,5-8,14H2,1-4H3/t10-/m0/s1
InChIKey
KCWQYYUIIOHOLI-JTQLQIEISA-N
Computed Properties
Structural Parameters
Heavy atom count
19
Fraction Csp3
0.85
Rotatable bonds
2
H-bond acceptors
5
H-bond donors
1
Molar refractivity
70.52
TPSA
81.86
LogP / Solubility
WLOGP
1.13
MLOGP
1.01
XLogP3
0.9
Consensus LogP
1.01
Log S (ESOL)
-2.11
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.61
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.61
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.58
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2
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![CAS 368866-21-1 1,3-Piperidinedicarboxylicacid,3-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-,1-(1,1-dimethylethyl)ester(9CI) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/368866-21-1(2).gif)
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![CAS 368866-33-5 (2S)-2-{[(tert-butoxy)carbonyl]amino}-3-(oxan-4-yl)propanoic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/368866-33-5(2).gif)
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