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CAS 915976-85-1 8-Bromo-7-chloro-2-methoxy-[1,5]naphthyridine molecular structure lightbox
CAS RN: 915976-85-1

8-Bromo-7-chloro-2-methoxy-[1,5]naphthyridine

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251201 100mg / 250mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS915976-85-1
  • Purity/Analytical Methods: >99.0%
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915976-85-1 / 8-bromo-7-chloro-2-methoxy-1,5-naphthyridine

Standard CAS: 915976-85-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
915976-85-1
Multi CAS
Yes
Molecular Formula
C9H6BRCLN2O
Molecular Weight
273.510000
Exact Mass
271.935200
InChI
InChI=1S/C9H6BrClN2O/c1-14-7-3-2-6-9(13-7)8(10)5(11)4-12-6/h2-4H,1H3
InChIKey
XZFOYBCRHMSKFH-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
10
Fraction Csp3
0.11
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
58.8
TPSA
35.01

LogP / Solubility

WLOGP
3.05
MLOGP
2.7
XLogP3
2.8
Consensus LogP
2.85
Log S (ESOL)
-3.92
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.01
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.09
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)
-2.22

Drug-likeness / Medicinal Chemistry

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

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