CAS RN: 362703-35-3
METHYL 4-AMINOMETHYL-1-BOC-PIPERIDINE-4-CARBOXYLATE
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Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 0.1g, 0.25g, 1g
- Available purity: >95%
- Inventory rows with stock: 3
- Bulk packaging: confirmed by inquiry
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Recorded sizes, purity and stock details for CAS 362703-35-3
| Pack Size |
Recorded Purity |
Available Qty |
Ship From |
Inquiry |
| 0.1g |
>95% |
1
In Stock
|
Hong Kong |
Inquiry |
| 0.25g |
>95% |
1
In Stock
|
Beijing |
Inquiry |
| 1g |
>95% |
1
In Stock
|
Hong Kong |
Inquiry |
362703-35-3 / 1-O-tert-butyl 4-O-methyl 4-(aminomethyl)piperidine-1,4-dicarboxylate
Standard CAS: 362703-35-3
Multi CAS: Yes
Basic Information
CAS
362703-35-3
Multi CAS
Yes
Molecular Formula
C13H24N2O4
Molecular Weight
272.340000
Exact Mass
272.173607
InChI
InChI=1S/C13H24N2O4/c1-12(2,3)19-11(17)15-7-5-13(9-14,6-8-15)10(16)18-4/h5-9,14H2,1-4H3
InChIKey
HZHZQEZZXBLFHO-UHFFFAOYSA-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
70.54
TPSA
81.86
LogP / Solubility
WLOGP
1.14
MLOGP
1.01
XLogP3
0.3
Consensus LogP
0.82
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
1.5