CAS RN: 105537-97-1
5-Phenyl-pyridazin-3-ylamine
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250512 | 100mg / 250mg / 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS105537-97-1
- Purity/Analytical Methods: >99.0%
105537-97-1 / 5-phenylpyridazin-3-amine
5-phenylpyridazin-3-amine | 5-Phenyl-pyridazin-3-ylamine | MFCD20700893
Basic Information
CAS
105537-97-1
Multi CAS
No
Molecular Formula
C10H9N3
Molecular Weight
171.200000
Exact Mass
171.079647
SMILES
C1=CC=C(C=C1)C2=CC(=NN=C2)N
InChI
InChI=1S/C10H9N3/c11-10-6-9(7-12-13-10)8-4-2-1-3-5-8/h1-7H,(H2,11,13)
InChIKey
MORAVCUWJRVGHR-UHFFFAOYSA-N
Synonyms
5-phenylpyridazin-3-amine
5-Phenyl-pyridazin-3-ylamine
MFCD20700893
5-phenyl-3-pyridazinamine
SCHEMBL17240179
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
12
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
51.88
TPSA
51.8
LogP / Solubility
WLOGP
1.73
MLOGP
1.52
XLogP3
1.1
Consensus LogP
1.45
Log S (ESOL)
-2.61
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.21
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.33
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.54
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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