6-chloro-5-iodopyridin-2-amine
CAS No.：
Cat. No.: SC24522
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Product Name :6-chloro-5-iodopyridin-2-amine
Cat. No.: :SC24522
Purity / Specification :—
CAS No. :1221398-11-3
MDL No. :MFCD20486991
Molecular Formula :C5H4ClIN2
LogP :2.10
Molecular Weight :254.46
TPSA :38.9
Category :Building Blocks
HSN Code :—
SMILES Code :Nc1ccc(I)c(Cl)n1
Melting Point :—
InChI Key : :LTQCXIAUNZHCCC-UHFFFAOYSA-N
Boiling Point :No data available
Application Note
AI GeneratedGenerated by AI. Verify before use in regulatory documents.
Lipinski & ADMET Properties
Computational estimateLipinski Rule of 5
iMW ≤ 500 Da✓ 254.5 Da
LogP ≤ 5✓ 2.10
HBD ≤ 5✓ 1
HBA ≤ 10✓ 2
Max 1 violation allowed for oral bioavailability.
Drug-likeness Score
i84/100
Good drug-like profile
Predicted LogP
i2.10log units
Optimal range (0–3)
CNS Permeability
iClark model · J Pharm Sci, 1999
CNS+ likely
TPSA 38.9Ų · Threshold: <60 CNS+ · 60–90 CNS± · >90 CNS−
Requires experimental confirmation.
⚠ These are computational estimates based on Lipinski & Veber physicochemical rules. They are not validated ADMET predictions and must not be used for clinical, regulatory, or safety decisions. For research use only.