CAS RN: 2375582-48-0
INDEX NAME NOT YET ASSIGNED
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250824 | 250mg / 1g | Confirm by inquiry | Shanghai | Inquiry |
- Product code: starshine_CAS2375582-48-0
- Purity/Analytical Methods: >99.0%
2375582-48-0 / 5-[4-(6-amino-3-pyridinyl)phenyl]pyridin-2-amine
Basic Information
CAS
2375582-48-0
Multi CAS
No
Molecular Formula
C16H14N4
Molecular Weight
262.310000
Exact Mass
262.121846
SMILES
C1=CC(=CC=C1C2=CN=C(C=C2)N)C3=CN=C(C=C3)N
InChI
InChI=1S/C16H14N4/c17-15-7-5-13(9-19-15)11-1-2-12(4-3-11)14-6-8-16(18)20-10-14/h1-10H,(H2,17,19)(H2,18,20)
InChIKey
ZXJLADLAGZRRNP-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
20
Aromatic heavy atom count
18
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
2
Molar refractivity
81.73
TPSA
77.82
LogP / Solubility
WLOGP
2.97
MLOGP
2.63
XLogP3
2.3
Consensus LogP
2.63
Log S (ESOL)
-3.87
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.86
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.07
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.21
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
1.5
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