![CAS 383392-66-3 5-[(Benzyloxy)methyl]-7-(1-pyrrolidinylmethyl)-8-quinolinol molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/383392-66-3.gif)
CAS RN: 383392-66-3
5-[(Benzyloxy)methyl]-7-(1-pyrrolidinylmethyl)-8-quinolinol
Product Availability
Choose a grade to view its available package options.
11 package records9 with current stock3 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260610 | 10mg / 50mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS383392-66-3
- Purity/Analytical Methods: >99.0%
383392-66-3 / 5-(phenylmethoxymethyl)-7-(pyrrolidin-1-ylmethyl)quinolin-8-ol
Basic Information
CAS
383392-66-3
Multi CAS
No
Molecular Formula
C22H24N2O2
Molecular Weight
348.400000
Exact Mass
348.183778
InChI
InChI=1S/C22H24N2O2/c25-22-18(14-24-11-4-5-12-24)13-19(20-9-6-10-23-21(20)22)16-26-15-17-7-2-1-3-8-17/h1-3,6-10,13,25H,4-5,11-12,14-16H2
InChIKey
LTGLGIQQZXSLLF-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
26
Aromatic heavy atom count
16
Fraction Csp3
0.32
Rotatable bonds
6
H-bond acceptors
4
H-bond donors
1
Molar refractivity
102.85
TPSA
45.59
LogP / Solubility
WLOGP
4.25
MLOGP
3.76
XLogP3
3.3
Consensus LogP
3.77
Log S (ESOL)
-4.74
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.49
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.17
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
No
Log Kp (skin permeation)
-1.83
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Leadlikeness
No
Synthetic Accessibility
3
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