CAS RN: 1784751-19-4
TA-02
Product Availability
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5 package records5 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20251025 | 5mg / 10mg / 50mg / 100mg | Confirm by inquiry | Shanghai | 5-7 business days | Inquiry |
- Product code: starshine_CAS1784751-19-4
- Purity/Analytical Methods: >99.0%
1784751-19-4 / 4-[2-(2-fluorophenyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl]pyridine
Basic Information
CAS
1784751-19-4
Multi CAS
No
Molecular Formula
C20H13F2N3
Molecular Weight
333.300000
Exact Mass
333.107754
SMILES
C1=CC=C(C(=C1)C2=NC(=C(N2)C3=CC=NC=C3)C4=CC=C(C=C4)F)F
InChI
InChI=1S/C20H13F2N3/c21-15-7-5-13(6-8-15)18-19(14-9-11-23-12-10-14)25-20(24-18)16-3-1-2-4-17(16)22/h1-12H,(H,24,25)
InChIKey
QIFJOFNVIVQRNJ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
25
Aromatic heavy atom count
23
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
1
Molar refractivity
92.61
TPSA
41.57
LogP / Solubility
WLOGP
5.08
MLOGP
4.49
XLogP3
4.2
Consensus LogP
4.59
Log S (ESOL)
-5.59
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.96
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.41
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.14
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
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![CAS 1784807-21-1 Tert-Butyl 7-Oxo-3,6-Diazabicyclo[3.2.2]Nonane-3-Carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1784807-21-1.gif)
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![CAS 1784871-38-0 5-bromo-3-isopropyl-2-methyl-3H-imidazo[4,5-b]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1784871-38-0.gif)