(3-bromopyrrol-1-yl)-tri(propan-2-yl)silane
CAS No.：
Cat. No.: SC23380
Available on Request
Price on Request
Contact us for pricing, MOQ, and lead time
Product Name :(3-bromopyrrol-1-yl)-tri(propan-2-yl)silane
Cat. No.: :SC23380
Purity / Specification :—
CAS No. :87630-36-2
MDL No. :MFCD0132113
Molecular Formula :C13H24BrNSi
LogP :5.27
Molecular Weight :302.33
TPSA :4.9
Category :Building Blocks
HSN Code :—
SMILES Code :CC(C)[Si](C(C)C)(C(C)C)n1ccc(Br)c1
Melting Point :—
InChI Key : :CNAUTMPRKBSDLH-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✓ 302.3 Da
LogP ≤ 5✗ 5.27
HBD ≤ 5✓ 0
HBA ≤ 10✓ 0
Max 1 violation allowed for oral bioavailability.
Drug-likeness Score
i55/100
Moderate — typical building block
Predicted LogP
i5.27log units
Highly lipophilic
CNS Permeability
iClark model · J Pharm Sci, 1999
CNS+ likely
TPSA 4.9Ų · 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.