CAS RN: 2074607-48-8
IWP-O1
Product Availability
Choose a grade to view its available package options.
8 package records2 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260621 | 5mg / 25mg / 100mg | Out of stock | 5-7 business days | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20251127 | 100mg | Out of stock | Inquiry | ||
| Batchno.20260614 | 10mg | Out of stock | Inquiry | ||
| Batchno.20250813 | 1g | Out of stock | Inquiry | ||
| Batchno.20260322 | 1mg | In stock | Wuhan | Inquiry | |
| Batchno.20250627 | 250mg | Out of stock | Inquiry | ||
| Batchno.20251228 | 50mg | In stock | Wuhan | Inquiry | |
| Batchno.20250630 | 5mg | Out of stock | Inquiry |
- Product code: starshine_CAS2074607-48-8
- Purity/Analytical Methods: >99.0%
2074607-48-8 / N-(5-phenyl-2-pyridinyl)-2-(5-phenyl-4-pyridin-4-yltriazol-1-yl)acetamide
Basic Information
CAS
2074607-48-8
Multi CAS
No
Molecular Formula
C26H20N6O
Molecular Weight
432.500000
Exact Mass
432.169859
SMILES
C1=CC=C(C=C1)C2=CN=C(C=C2)NC(=O)CN3C(=C(N=N3)C4=CC=NC=C4)C5=CC=CC=C5
InChI
InChI=1S/C26H20N6O/c33-24(29-23-12-11-22(17-28-23)19-7-3-1-4-8-19)18-32-26(21-9-5-2-6-10-21)25(30-31-32)20-13-15-27-16-14-20/h1-17H,18H2,(H,28,29,33)
InChIKey
GYYDQHBKIHQHEB-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
33
Aromatic heavy atom count
29
Fraction Csp3
0.04
Rotatable bonds
6
H-bond acceptors
6
H-bond donors
1
Molar refractivity
126.99
TPSA
85.59
LogP / Solubility
WLOGP
4.71
MLOGP
4.17
XLogP3
3.8
Consensus LogP
4.23
Log S (ESOL)
-5.74
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.51
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.1
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.02
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5
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