CAS RN: 1049729-27-2
(FMoc-4-aMinoMethyl)-piperidine, HCl
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.20260522 | 100mg / 250mg / 1g / 5g | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-006718
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 |
1049729-27-2 / 9H-fluoren-9-ylmethyl N-(piperidin-4-ylmethyl)carbamate;hydrochloride
(Fmoc-4-aminomethyl)-piperidine, HCl | 4-n-fmoc-aminomethyl piperidine hcl | (Fmoc-4-aminomethyl)piperidine hydrochloride
Basic Information
CAS
1049729-27-2
Multi CAS
No
Molecular Formula
C21H25ClN2O2
Molecular Weight
372.900000
Exact Mass
372.160456
SMILES
C1CNCCC1CNC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24.Cl
InChI
InChI=1S/C21H24N2O2.ClH/c24-21(23-13-15-9-11-22-12-10-15)25-14-20-18-7-3-1-5-16(18)17-6-2-4-8-19(17)20;/h1-8,15,20,22H,9-14H2,(H,23,24);1H
InChIKey
VLBVRKBJLLWDNL-UHFFFAOYSA-N
Synonyms
(Fmoc-4-aminomethyl)-piperidine, HCl
4-n-fmoc-aminomethyl piperidine hcl
(Fmoc-4-aminomethyl)piperidine hydrochloride
(Fmoc-4-aminomethyl)-piperidine hydrochloride
MFCD03093511
Computed Properties
Structural Parameters
Heavy atom count
26
Aromatic heavy atom count
12
Fraction Csp3
0.38
Rotatable bonds
4
H-bond acceptors
3
H-bond donors
2
Molar refractivity
105.91
TPSA
50.36
LogP / Solubility
WLOGP
3.95
MLOGP
3.49
XLogP3
3.95
Consensus LogP
3.8
Log S (ESOL)
-4.72
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.47
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.84
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.19
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
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