![CAS 853576-50-8 (2′,3′,5′,6′-Tetrahydro-1’H-[2,4′]bipyridinyl-4′-yl)-methanol molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/853576-50-8.png)
CAS RN: 853576-50-8
(2′,3′,5′,6′-Tetrahydro-1’H-[2,4′]bipyridinyl-4′-yl)-methanol
Product Availability
Available package options are listed below.
1 package records0 with current stock
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250313 | 200mg | Out of stock | 5-7 business days | Inquiry |
- Product code: LINT927304
853576-50-8 / (4-pyridin-2-ylpiperidin-4-yl)methanol
Basic Information
CAS
853576-50-8
Multi CAS
No
Molecular Formula
C11H16N2O
Molecular Weight
192.260000
Exact Mass
192.126263
InChI
InChI=1S/C11H16N2O/c14-9-11(4-7-12-8-5-11)10-3-1-2-6-13-10/h1-3,6,12,14H,4-5,7-9H2
InChIKey
JIWTTXFKHUWNNI-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.55
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
2
Molar refractivity
55.1
TPSA
45.15
LogP / Solubility
WLOGP
0.7
MLOGP
0.61
XLogP3
0.3
Consensus LogP
0.54
Log S (ESOL)
-1.66
Class (ESOL)
Soluble
Log S (Ali)
-1.64
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.73
Class (SILICOS-IT)
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)
-3.4
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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