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CAS 28832-58-8 2-Naphthalenol,1-[2-(5-chloro-2-pyridinyl) diazenyl]- molecular structure lightbox
CAS RN: 28832-58-8

2-Naphthalenol,1-[2-(5-chloro-2-pyridinyl) diazenyl]-

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250512 50mg / 250mg / 1g Confirm by inquiry Shanghai 5-7 business days Inquiry
  • Product code: starshine_CAS28832-58-8
  • Purity/Analytical Methods: >99.0%
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28832-58-8 / 1-[(5-chloro-2-pyridinyl)diazenyl]naphthalen-2-ol

Standard CAS: 28832-58-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
28832-58-8
Multi CAS
No
Molecular Formula
C15H10ClN3O
Molecular Weight
283.710000
Exact Mass
283.051240
InChI
InChI=1S/C15H10ClN3O/c16-11-6-8-14(17-9-11)18-19-15-12-4-2-1-3-10(12)5-7-13(15)20/h1-9,20H
InChIKey
GLVGIWOEYVSICM-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
16
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
79.04
TPSA
57.84

LogP / Solubility

WLOGP
5.01
MLOGP
4.42
XLogP3
4.5
Consensus LogP
4.64
Log S (ESOL)
-5.21
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.5
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.9
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
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.89

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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