AC1MVHVU
8-butyl-11-thia-9,14,16,17,19-pentazapentacyclo[10.7.0.02,10.03,7.013,17]nonadeca-1(12),2(10),3(7),8,13,15,18-heptaene
Also Known As: 10-butyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidine
CAS: 799802-20-3
| Molecular Formula | C17H17N5S |
|---|---|
| Molecular Weight | 323.12045 g/mol |
| LogP | 3.7185 |
| Topological Polar Surface Area | 55.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 323.12045 |
| Monoisotopic Mass | 323.12045 |
| Heavy Atoms | 23 |
| Complexity | 1045.6173 |
Chemical Identifiers
| CAS Number | 799802-20-3 |
|---|---|
| SMILES | CCCCC1=NC2=C(C3=C1CCC3)C4=C(S2)C5=NC=NN5C=N4 |
Product Overview
AC1MVHVU (CAS 799802-20-3), with molecular formula C17H17N5S and molecular weight 323.12045 g/mol. IUPAC: 8-butyl-11-thia-9,14,16,17,19-pentazapentacyclo[10.7.0.02,10.03,7.013,17]nonadeca-1(12),2(10),3(7),8,13,15,18-heptaene.
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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