Pentane-1,5-diamine;hydrochloride
CAS No.：
Cat. No.: SC251258
Available on Request
Price on Request
Contact us for pricing, MOQ, and lead time
Product Name :Pentane-1,5-diamine;hydrochloride
Cat. No.: :SC251258
Purity / Specification :—
CAS No. :1476-39-7
MDL No. :—
Molecular Formula :C5H16Cl2N2
LogP :0.50
Molecular Weight :175.10
TPSA :52.0
Category :CRO / Contract Research
HSN Code :—
SMILES Code :C(CCN)CCN.Cl
Melting Point :—
InChI Key : :RLNAIWYXIAJDTN-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✓ 175.1 Da
LogP ≤ 5✓ 0.50
HBD ≤ 5✓ 3
HBA ≤ 10✓ 2
Max 1 violation allowed for oral bioavailability.
Drug-likeness Score
i59/100
Moderate — typical building block
Predicted LogP
i0.50log units
Optimal range (0–3)
CNS Permeability
iClark model · J Pharm Sci, 1999
CNS+ likely
TPSA 52.0Ų · 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.