CAS RN: 889992-97-6

3-(5-Methylfuran-2-yl)-1H-pyrazole-5-carbohydrazide

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Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250731 100mg / 250mg / 500mg / 1g Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS889992-97-6
  • Purity/Analytical Methods: >99.0%
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889992-97-6 / 5-(5-methylfuran-2-yl)-1H-pyrazole-3-carbohydrazide

Standard CAS: 889992-97-6 Multi CAS: No

Basic Information

CAS
889992-97-6
Multi CAS
No
Molecular Formula
C9H10N4O2
Molecular Weight
206.200000
Exact Mass
206.080376
InChI
InChI=1S/C9H10N4O2/c1-5-2-3-8(15-5)6-4-7(13-12-6)9(14)11-10/h2-4H,10H2,1H3,(H,11,14)(H,12,13)
InChIKey
ZXRCSEZSNYNNAD-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
10
Fraction Csp3
0.11
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
3
Molar refractivity
52.68
TPSA
96.94

LogP / Solubility

WLOGP
0.58
MLOGP
0.51
XLogP3
0.2
Consensus LogP
0.43
Log S (ESOL)
-1.85
Class (ESOL)
Soluble
Log S (Ali)
-1.67
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.72
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.56

Drug-likeness / Medicinal Chemistry

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

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