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CAS 642477-85-8 8-(benzyloxy)-2-methoxyquinoline(WX130468) molecular structure lightbox
CAS RN: 642477-85-8

8-(benzyloxy)-2-methoxyquinoline(WX130468)

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260316 100mg Out of stock 30 business days Inquiry
  • Product code: starshine_CAS642477-85-8
  • Purity/Analytical Methods: >99.0%
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642477-85-8 / 2-methoxy-8-phenylmethoxyquinoline

Standard CAS: 642477-85-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
642477-85-8
Multi CAS
No
Molecular Formula
C17H15NO2
Molecular Weight
265.310000
Exact Mass
265.110279
InChI
InChI=1S/C17H15NO2/c1-19-16-11-10-14-8-5-9-15(17(14)18-16)20-12-13-6-3-2-4-7-13/h2-11H,12H2,1H3
InChIKey
ZSEKOQOZBSHNTG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
16
Fraction Csp3
0.12
Rotatable bonds
4
H-bond acceptors
3
Molar refractivity
79.07
TPSA
31.35

LogP / Solubility

WLOGP
3.82
MLOGP
3.37
XLogP3
3.8
Consensus LogP
3.66
Log S (ESOL)
-4.22
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.5
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.04
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.62

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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