![CAS 145148-39-6 3-PiperidinaMine, N-[(2-Methoxyphenyl)Methyl]-2-phenyl-, (Hydrochloride) (1:2), (2S,3S)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/145148-39-6.gif)
CAS RN: 145148-39-6
3-PiperidinaMine, N-[(2-Methoxyphenyl)Methyl]-2-phenyl-, (Hydrochloride) (1:2), (2S,3S)-
Product Availability
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250922 | 5mg / 25mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS145148-39-6
- Purity/Analytical Methods: >99.0%
145148-39-6 / (2S,3S)-N-[(2-methoxyphenyl)methyl]-2-phenylpiperidin-3-amine;dihydrochloride
Basic Information
CAS
145148-39-6
Multi CAS
No
Molecular Formula
C19H26Cl2N2O
Molecular Weight
369.300000
Exact Mass
368.142219
SMILES
COC1=CC=CC=C1CN[C@H]2CCCN[C@H]2C3=CC=CC=C3.Cl.Cl
InChI
InChI=1S/C19H24N2O.2ClH/c1-22-18-12-6-5-10-16(18)14-21-17-11-7-13-20-19(17)15-8-3-2-4-9-15;;/h2-6,8-10,12,17,19-21H,7,11,13-14H2,1H3;2*1H/t17-,19-;;/m0../s1
InChIKey
WNHRFWPLRATIDT-FFUVTKDNSA-N
Computed Properties
Structural Parameters
Heavy atom count
24
Aromatic heavy atom count
12
Fraction Csp3
0.37
Rotatable bonds
5
H-bond acceptors
3
H-bond donors
2
Molar refractivity
104.54
TPSA
33.29
LogP / Solubility
WLOGP
4.12
MLOGP
3.65
XLogP3
4.12
Consensus LogP
3.96
Log S (ESOL)
-4.77
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.56
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.08
Class (SILICOS-IT)
Insoluble
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)
-2.05
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5
Safety & Transport
Pictogram(s)
Environmental Hazard
Signal
Warning
GHS Hazard Statements
H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
H410 (100%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]
Precautionary Statement Codes
P273, P391, and P501
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