AC1LYP3Z
3-(furan-2-ylmethyl)-2-prop-2-ynylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one
Also Known As: 3-(furan-2-ylmethyl)-2-(prop-2-yn-1-ylthio)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one|3-(furan-2-ylmethyl)-2-(prop-2-yn-1-ylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one|3-(furan-2-ylmethyl)-2-prop-2-ynylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one
CAS: 836642-83-2
| Molecular Formula | C24H22N2O2S |
|---|---|
| Molecular Weight | 402.1402 g/mol |
| LogP | 4.6448 |
| Topological Polar Surface Area | 48.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.1402 |
| Monoisotopic Mass | 402.1402 |
| Heavy Atoms | 29 |
| Complexity | 1148.6091 |
Chemical Identifiers
| CAS Number | 836642-83-2 |
|---|---|
| SMILES | C#CCSC1=NC2=C(C(=O)N1CC3=CC=CO3)C4(CCCC4)CC5=CC=CC=C52 |
Product Overview
AC1LYP3Z (CAS 836642-83-2), with molecular formula C24H22N2O2S and molecular weight 402.1402 g/mol. IUPAC: 3-(furan-2-ylmethyl)-2-prop-2-ynylsulfanylspiro[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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