(1-allyl-3-bromo-3-oxido-1-oxa-4-azatricyclo[3.3.1.03,7]non-6-en-2-yl) acetate

CAS No.：

Cat. No.: SC24599

Available on Request

Price on Request

Bulk Inquiry

Product Name :(1-allyl-3-bromo-3-oxido-1-oxa-4-azatricyclo[3.3.1.03,7]non-6-en-2-yl) acetate

Cat. No.: :SC24599

Purity / Specification :—

CAS No. :—

MDL No. :—

Molecular Formula :C₁₆H₁₅BrO₂

LogP :—

Molecular Weight :319.20

TPSA :—

Category :Building Blocks

HSN Code :—

SMILES Code :O=C(O)C(CCBr)(c1ccccc1)c1ccccc1

Melting Point :—

InChI Key : :—

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

MW ≤ 500 Da✓ 319.2 Da

LogP ≤ 5— N/A

HBD ≤ 5— N/A

HBA ≤ 10— N/A

Max 1 violation allowed for oral bioavailability.

Drug-likeness Score

99/100

Excellent drug-like profile

Predicted LogP

N/A

CNS Permeability

Clark model · J Pharm Sci, 1999

TPSA data required

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.