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CAS 321385-58-4 5-[4-(1H-IMIDAZOL-1-YL)PHENYL]-1H-PYRAZOLE molecular structure lightbox
CAS RN: 321385-58-4

5-[4-(1H-IMIDAZOL-1-YL)PHENYL]-1H-PYRAZOLE

Product Availability

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5 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250516 100mg In stock Shanghai Inquiry
Batchno.20260625 1g In stock Shanghai Inquiry
Batchno.20251209 250mg In stock Shanghai Inquiry
Batchno.20251011 5g In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250617 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS321385-58-4
  • Purity/Analytical Methods: >99.0%
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321385-58-4 / 1-[4-(1H-pyrazol-5-yl)phenyl]imidazole

Standard CAS: 321385-58-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
321385-58-4
Multi CAS
No
Molecular Formula
C12H10N4
Molecular Weight
210.230000
Exact Mass
210.090546
InChI
InChI=1S/C12H10N4/c1-3-11(16-8-7-13-9-16)4-2-10(1)12-5-6-14-15-12/h1-9H,(H,14,15)
InChIKey
UFXSELGOGDVWDO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
16
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
61.15
TPSA
46.5

LogP / Solubility

WLOGP
2.26
MLOGP
1.99
XLogP3
1.6
Consensus LogP
1.95
Log S (ESOL)
-3.18
Class (ESOL)
Poorly soluble
Log S (Ali)
-2.92
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.14
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.4

Drug-likeness / Medicinal Chemistry

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

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