CAS RN: 7006-48-6
4-(Methylamino)-1-benzylpiperidine Dihydrochloride
- Product code: SSC-179849
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: 5g
- 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 |
|---|---|---|---|---|
| 5g | ≥95% | 0 Out of Stock | Shenzhen | Inquiry |
7006-48-6 / 1-benzyl-N-methylpiperidin-4-amine;dihydrochloride
Basic Information
CAS
7006-48-6
Multi CAS
Yes
Molecular Formula
C13H22CL2N2
Molecular Weight
277.230000
Exact Mass
276.116004
InChI
InChI=1S/C13H20N2.2ClH/c1-14-13-7-9-15(10-8-13)11-12-5-3-2-4-6-12;;/h2-6,13-14H,7-11H2,1H3;2*1H
InChIKey
JWQWEXNKJNNJQM-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
6
Fraction Csp3
0.54
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
1
Molar refractivity
78.3
TPSA
15.27
LogP / Solubility
WLOGP
2.71
MLOGP
2.4
XLogP3
2.71
Consensus LogP
2.61
Log S (ESOL)
-3.33
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.79
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.07
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.48
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
1.5
Customers Also Viewed
-
-
4-diazo-4H-imidazole-5-carboxamide
- CAS RN: 7008-85-7
- Product Code: starshine_CAS7008-85-7
- Purity/Analytical method: >99.0%
-
4-[2-(diethylamino)ethoxy]benzophenone
- CAS RN: 796-77-0
- Product Code: starshine_CAS796-77-0
- Purity/Analytical method: >99.0%
-
Phenol, 4-[[bis(2-hydroxyethyl)amino]methyl]-2,6-bis(1,1-dimethylethyl)-
- CAS RN: 799-25-7
- Product Code: starshine_CAS799-25-7
- Purity/Analytical method: >99.0%
-
3-(1H,1H,7H-DODECAFLUOROHEPTYLOXY)-1,2-EPOXYPROPANE
- CAS RN: 799-34-8
- Product Code: starshine_CAS799-34-8
- Purity/Analytical method: >99.0%
-
![CAS 796-77-0 4-[2-(diethylamino)ethoxy]benzophenone molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/796-77-0.gif)
![CAS 799-25-7 Phenol, 4-[[bis(2-hydroxyethyl)amino]methyl]-2,6-bis(1,1-dimethylethyl)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/799-25-7.gif)
