CAS RN: 2162962-69-6
CU-CPT-9a
Product Availability
Choose a grade to view its available package options.
10 package records7 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260623 | 100mg | Out of stock | Inquiry | |
| Batchno.20260310 | 10mg | In stock | Shanghai, Tianjin | Inquiry |
| Batchno.20260415 | 1g | Out of stock | Inquiry | |
| Batchno.20250127 | 1mg | In stock | Shanghai, Tianjin | Inquiry |
| Batchno.20251127 | 250mg | Out of stock | Inquiry | |
| Batchno.20260123 | 25mg | In stock | Shanghai, Tianjin | Inquiry |
| Batchno.20250203 | 50mg | In stock | Tianjin | Inquiry |
| Batchno.20250508 | 5mg | In stock | Shanghai, Tianjin | Inquiry |
- Product code: starshine_CAS2162962-69-6
- Purity/Analytical Methods: >99.0%
2162962-69-6 / 4-(4-hydroxy-3-methylphenyl)quinolin-7-ol
Basic Information
CAS
2162962-69-6
Multi CAS
No
Molecular Formula
C16H13NO2
Molecular Weight
251.280000
Exact Mass
251.094629
SMILES
CC1=C(C=CC(=C1)C2=C3C=CC(=CC3=NC=C2)O)O
InChI
InChI=1S/C16H13NO2/c1-10-8-11(2-5-16(10)19)13-6-7-17-15-9-12(18)3-4-14(13)15/h2-9,18-19H,1H3
InChIKey
QXFYDRYRLOHSBD-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
19
Aromatic heavy atom count
16
Fraction Csp3
0.06
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
2
Molar refractivity
75.25
TPSA
53.35
LogP / Solubility
WLOGP
3.62
MLOGP
3.19
XLogP3
3.5
Consensus LogP
3.44
Log S (ESOL)
-4.24
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.24
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.42
Class (SILICOS-IT)
Slightly 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)
-1.68
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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