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CAS 959217-50-6 8-Chloro-2-ethoxy-1,5-naphthyridine molecular structure lightbox
CAS RN: 959217-50-6

8-Chloro-2-ethoxy-1,5-naphthyridine

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250805 25mg / 100mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS959217-50-6
  • Purity/Analytical Methods: >99.0%
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959217-50-6 / 8-chloro-2-ethoxy-1,5-naphthyridine

Standard CAS: 959217-50-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
959217-50-6
Multi CAS
No
Molecular Formula
C10H9CLN2O
Molecular Weight
208.640000
Exact Mass
208.040341
InChI
InChI=1S/C10H9ClN2O/c1-2-14-9-4-3-8-10(13-9)7(11)5-6-12-8/h3-6H,2H2,1H3
InChIKey
DBTQROPNZVNFMR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
10
Fraction Csp3
0.2
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
55.72
TPSA
35.01

LogP / Solubility

WLOGP
2.68
MLOGP
2.36
XLogP3
2.5
Consensus LogP
2.51
Log S (ESOL)
-3.22
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.21
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.48
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)
-2.09

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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