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CAS 63468-94-0 2-(quinolin-3-yl)hydrazine hydrochloride molecular structure lightbox
CAS RN: 63468-94-0

2-(quinolin-3-yl)hydrazine hydrochloride

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251110 100mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS63468-94-0
  • Purity/Analytical Methods: >99.0%
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63468-94-0 / quinolin-3-ylhydrazine;hydrochloride

Standard CAS: 63468-94-0 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
63468-94-0
Multi CAS
No
Molecular Formula
C9H10CLN3
Molecular Weight
195.650000
Exact Mass
195.056325
InChI
InChI=1S/C9H9N3.ClH/c10-12-8-5-7-3-1-2-4-9(7)11-6-8;/h1-6,12H,10H2;1H
InChIKey
BOJSQUHIRFMBLP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
10
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
2
Molar refractivity
56.8
TPSA
50.94

LogP / Solubility

WLOGP
1.94
MLOGP
1.71
XLogP3
1.94
Consensus LogP
1.86
Log S (ESOL)
-2.78
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.57
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.66
Class (SILICOS-IT)
Moderately 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)
-2.53

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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