![CAS 1630906-32-9 tert-butyl N-[4-(hydroxymethyl)-1-methylpiperidin-4-yl]carbamate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1630906-32-9.gif)
CAS RN: 1630906-32-9
tert-butyl N-[4-(hydroxymethyl)-1-methylpiperidin-4-yl]carbamate
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.20251123 | 500mg | Out of stock | 15 business days | Inquiry |
- Product code: SSC-070729
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 1g
- Available purity: ≥95%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥95% | 0 Out of Stock | Hong Kong | Inquiry |
1630906-32-9 / tert-butyl N-[4-(hydroxymethyl)-1-methylpiperidin-4-yl]carbamate
Basic Information
CAS
1630906-32-9
Multi CAS
No
Molecular Formula
C12H24N2O3
Molecular Weight
244.330000
Exact Mass
244.178693
SMILES
CC(C)(C)OC(=O)NC1(CCN(CC1)C)CO
InChI
InChI=1S/C12H24N2O3/c1-11(2,3)17-10(16)13-12(9-15)5-7-14(4)8-6-12/h15H,5-9H2,1-4H3,(H,13,16)
InChIKey
VNENCTWMYITKRE-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Fraction Csp3
0.92
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
2
Molar refractivity
65.92
TPSA
61.8
LogP / Solubility
WLOGP
0.97
MLOGP
0.86
XLogP3
0.7
Consensus LogP
0.84
Log S (ESOL)
-1.83
Class (ESOL)
Soluble
Log S (Ali)
-2.26
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.29
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)
-3.52
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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