CAS RN: 1951441-59-0
4-amino-3-pyridinecarboxamide hydrochloride
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.20250915 | 100mg | Out of stock | 1 business days | Inquiry |
- Product code: starshine_CAS1951441-59-0
- Purity/Analytical Methods: >99.0%
1951441-59-0 / 4-aminopyridine-3-carboxamide;hydrochloride
Basic Information
CAS
1951441-59-0
Multi CAS
No
Molecular Formula
C6H8ClN3O
Molecular Weight
173.600000
Exact Mass
173.035590
SMILES
C1=CN=CC(=C1N)C(=O)N.Cl
InChI
InChI=1S/C6H7N3O.ClH/c7-5-1-2-9-3-4(5)6(8)10;/h1-3H,(H2,7,9)(H2,8,10);1H
InChIKey
UCRWZANXSZDIPE-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
2
Molar refractivity
44.42
TPSA
82
LogP / Solubility
WLOGP
0.18
MLOGP
0.16
XLogP3
0.18
Consensus LogP
0.17
Log S (ESOL)
-1.37
Class (ESOL)
Soluble
Log S (Ali)
-1.12
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.06
Class (SILICOS-IT)
Soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.65
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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