AC1LYP5B
3-(2-methylpropyl)-2-pentylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one
Also Known As: 3-isobutyl-2-(pentylthio)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one|3-(2-methylpropyl)-2-pentylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one|3-(2-methylpropyl)-2-(pentylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
CAS: 836642-91-2
| Molecular Formula | C25H34N2OS |
|---|---|
| Molecular Weight | 410.2392 g/mol |
| LogP | 6.2165 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 410.2392 |
| Monoisotopic Mass | 410.2392 |
| Heavy Atoms | 29 |
| Complexity | 924.906 |
Chemical Identifiers
| CAS Number | 836642-91-2 |
|---|---|
| SMILES | CCCCCSC1=NC2=C(C(=O)N1CC(C)C)C3(CCCC3)CC4=CC=CC=C42 |
Product Overview
AC1LYP5B (CAS 836642-91-2), with molecular formula C25H34N2OS and molecular weight 410.2392 g/mol. IUPAC: 3-(2-methylpropyl)-2-pentylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one.
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.
View MSDS →
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