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CAS 79984-63-7 N’-(2-Methoxyphenyl)Acetohydrazide molecular structure lightbox
CAS RN: 79984-63-7

N’-(2-Methoxyphenyl)Acetohydrazide

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250203 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS79984-63-7
  • Purity/Analytical Methods: >99.0%
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79984-63-7 / N'-(2-methoxyphenyl)acetohydrazide

Standard CAS: 79984-63-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
79984-63-7
Multi CAS
No
Molecular Formula
C9H12N2O2
Molecular Weight
180.200000
Exact Mass
180.089878
InChI
InChI=1S/C9H12N2O2/c1-7(12)10-11-8-5-3-4-6-9(8)13-2/h3-6,11H,1-2H3,(H,10,12)
InChIKey
IAHNAHJRZNELLZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.22
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
2
Molar refractivity
50.43
TPSA
50.36

LogP / Solubility

WLOGP
1.16
MLOGP
1.02
XLogP3
1.4
Consensus LogP
1.19
Log S (ESOL)
-1.83
Class (ESOL)
Soluble
Log S (Ali)
-1.87
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.15
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3

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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