N-([1,2,4]triazolo[4,3-a]pyridin-6-yl)-1-(o-tolyl)methanesulfonamide

CAS No.：

Cat. No.: SC251095

Available on Request

Price on Request

Bulk Inquiry

Product Name :N-([1,2,4]triazolo[4,3-a]pyridin-6-yl)-1-(o-tolyl)methanesulfonamide

Cat. No.: :SC251095

Purity / Specification :—

CAS No. :1797745-94-8

MDL No. :—

Molecular Formula :C₁₄H₁₄N₄O₂S

LogP :1.98

Molecular Weight :302.35

TPSA :76.4

Category :CRO / Contract Research

HSN Code :—

SMILES Code :Cc1ccccc1CS(=O)(=O)Nc1ccc2nncn2c1

Melting Point :—

InChI Key : :QEMUEGILYAQCAE-UHFFFAOYSA-N

Boiling Point :No data available

Application Note

AI Generated

Generated by AI. Verify before use in regulatory documents.

Lipinski & ADMET Properties

Computational estimate

Lipinski Rule of 5

✓ PASS

MW ≤ 500 Da✓ 302.4 Da

LogP ≤ 5✓ 1.98

HBD ≤ 5✓ 1

HBA ≤ 10✓ 4

Max 1 violation allowed for oral bioavailability.

Drug-likeness Score

95/100

Excellent drug-like profile

Predicted LogP

1.98log units

Optimal range (0–3)

CNS Permeability

Clark model · J Pharm Sci, 1999

CNS± borderline

TPSA 76.4Å² · 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.