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CAS 332884-35-2 2-AMINO-6-PYRIDINE CARBOXALDEHYDE molecular structure lightbox
CAS RN: 332884-35-2

2-AMINO-6-PYRIDINE CARBOXALDEHYDE

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260321 50mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS332884-35-2
  • Purity/Analytical Methods: >99.0%
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332884-35-2 / 6-aminopyridine-2-carbaldehyde

Standard CAS: 332884-35-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
332884-35-2
Multi CAS
No
Molecular Formula
C6H6N2O
Molecular Weight
122.120000
Exact Mass
122.048013
SMILES
C1=CC(=NC(=C1)N)C=O
InChI
InChI=1S/C6H6N2O/c7-6-3-1-2-5(4-9)8-6/h1-4H,(H2,7,8)
InChIKey
PXYOOBSFOBZSBX-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
34.04
TPSA
55.98

LogP / Solubility

WLOGP
0.48
MLOGP
0.41
XLogP3
0.3
Consensus LogP
0.4
Log S (ESOL)
-1.32
Class (ESOL)
Soluble
Log S (Ali)
-0.91
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.97
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.13

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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