CHEMBL376440
12-cyclopentyl-10-ethyl-5-thiophen-3-yl-3,4,6,11,12-pentazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,10-tetraene
Also Known As: 9-Cyclopentyl-7-ethyl-6,9-dihydro-3-(3-thienyl)-5H-pyrazolo[3,4-c]-1,2,4-triazolo[4,3-a]pyridine|9-Cyclopentyl-7-ethyl-3-(thiophen-3-yl)-6,9-dihydro-5H-pyrazolo[3,4-c][1,2,4]triazolo[4,3-a]pyridine
CAS: 477529-72-9
| Molecular Formula | C18H21N5S |
|---|---|
| Molecular Weight | 339.15176 g/mol |
| LogP | 4.1037 |
| Topological Polar Surface Area | 48.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.15176 |
| Monoisotopic Mass | 339.15176 |
| Heavy Atoms | 24 |
| Complexity | 867.74786 |
Chemical Identifiers
| CAS Number | 477529-72-9 |
|---|---|
| SMILES | CCC1=NN(C2=C1CCN3C2=NN=C3C4=CSC=C4)C5CCCC5 |
Product Overview
CHEMBL376440 (CAS 477529-72-9), with molecular formula C18H21N5S and molecular weight 339.15176 g/mol. IUPAC: 12-cyclopentyl-10-ethyl-5-thiophen-3-yl-3,4,6,11,12-pentazatricyclo[7.3.0.02,6]dodeca-1(9),2,4,10-tetraene.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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