CAS RN: 371981-27-0
(2-(Piperidin-4-yl)phenyl)methanol hydrochloride
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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 371981-27-0
| Pack Size |
Recorded Purity |
Available Qty |
Ship From |
Inquiry |
| 0.1g |
>95% |
5
In Stock
|
Shenzhen |
Inquiry |
| 0.25g |
>95% |
5
In Stock
|
Hong Kong |
Inquiry |
| 1g |
>95% |
5
In Stock
|
Beijing |
Inquiry |
371981-27-0 / (2-piperidin-4-ylphenyl)methanol;hydrochloride
Standard CAS: 371981-27-0
Multi CAS: No
Basic Information
CAS
371981-27-0
Multi CAS
No
Molecular Formula
C12H18CLNO
Molecular Weight
227.730000
Exact Mass
227.107692
InChI
InChI=1S/C12H17NO.ClH/c14-9-11-3-1-2-4-12(11)10-5-7-13-8-6-10;/h1-4,10,13-14H,5-9H2;1H
InChIKey
JHAHARBIBNQYLZ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
2
Molar refractivity
64.46
TPSA
32.26
LogP / Solubility
WLOGP
2.07
MLOGP
1.82
XLogP3
2.07
Consensus LogP
1.99
Log S (ESOL)
-2.72
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.92
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.1
Class (SILICOS-IT)
Poorly 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)
-2.64
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5