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CAS 23443-09-6 4-HYDROXYBENZO[H]QUINOLINE molecular structure lightbox
CAS RN: 23443-09-6

4-HYDROXYBENZO[H]QUINOLINE

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250213 100mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS23443-09-6
  • Purity/Analytical Methods: >99.0%
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23443-09-6 / 1H-benzo[h]quinolin-4-one

Standard CAS: 23443-09-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
23443-09-6
Multi CAS
No
Molecular Formula
C13H9NO
Molecular Weight
195.220000
Exact Mass
195.068414
SMILES
C1=CC=C2C(=C1)C=CC3=C2NC=CC3=O
InChI
InChI=1S/C13H9NO/c15-12-7-8-14-13-10-4-2-1-3-9(10)5-6-11(12)13/h1-8H,(H,14,15)
InChIKey
TXJHJSRAIZDOMP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
14
H-bond acceptors
1
H-bond donors
1
Molar refractivity
62.07
TPSA
32.86

LogP / Solubility

WLOGP
2.68
MLOGP
2.36
XLogP3
2.8
Consensus LogP
2.61
Log S (ESOL)
-3.43
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.1
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.15
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.01

Drug-likeness / Medicinal Chemistry

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

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