![CAS 4875-41-6 4-(4-chlorophenyl)tetrahydroimidazo[4,5-c]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/4875-41-6.gif)
CAS RN: 4875-41-6
4-(4-chlorophenyl)tetrahydroimidazo[4,5-c]pyridine
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.20260530 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS4875-41-6
- Purity/Analytical Methods: >99.0%
4875-41-6 / 4-(4-chlorophenyl)-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine
Basic Information
CAS
4875-41-6
Multi CAS
Yes
Molecular Formula
C12H12CLN3
Molecular Weight
233.690000
Exact Mass
233.071975
InChI
InChI=1S/C12H12ClN3/c13-9-3-1-8(2-4-9)11-12-10(5-6-14-11)15-7-16-12/h1-4,7,11,14H,5-6H2,(H,15,16)
InChIKey
VIYSCMWHBOQBRJ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
16
Aromatic heavy atom count
11
Fraction Csp3
0.25
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
63.59
TPSA
40.71
LogP / Solubility
WLOGP
2.3
MLOGP
2.03
XLogP3
1.9
Consensus LogP
2.08
Log S (ESOL)
-3.18
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.14
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.21
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.51
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
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![CAS 4880-87-9 (8’aR)-1′-Acetyl-2′,3′,8′,8’a-tetrahydro-5′,6′-dimethoxyspiro[2,5-cyclohexadiene-1,7′(1’H)-cyclopent[ij]isoquinolin]-4-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/4880-87-9.gif)
