3,5-dimethyl-1,2-oxazol-4-amine;hydrochloride
CAS No.:
Cat. No.: SC20082
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Product Name :3,5-dimethyl-1,2-oxazol-4-amine;hydrochloride
Cat. No.: :SC20082
Purity / Specification :—
CAS No. :127107-28-2
MDL No. :MFCD04969912
Molecular Formula :C5H9ClN2O
LogP :1.30
Molecular Weight :148.59
TPSA :52.1
Category :Building Blocks
HSN Code :—
SMILES Code :Cc1noc(C)c1N.Cl
Melting Point :—
InChI Key : :QEKHGKNGSDHSLM-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✓ 148.6 Da
LogP ≤ 5✓ 1.30
HBD ≤ 5✓ 2
HBA ≤ 10✓ 3
Max 1 violation allowed for oral bioavailability.
Drug-likeness Score
i66/100
Moderate — typical building block
Predicted LogP
i1.30log units
Optimal range (0–3)
CNS Permeability
iClark model · J Pharm Sci, 1999
CNS+ likely
TPSA 52.1Ų · 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.
