AC1MJ2EB
2-phenacylsulfanyl-3-prop-2-enylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one
Also Known As: Oprea1_090156|Oprea1_823166|BAS 01322174|AN-038/12878005|3-allyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-5,6-dihydrospiro(benzo[h]quinazoline-5,1'-cyclopentane)-4(3H)-one|2-phenacylsulfanyl-3-prop-2-enylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one|2-[(2-oxo-2-phenylethyl)sulfanyl]-3-(prop-2-en-1-yl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one|2-(2-oxo-2-phenylethylthio)-3-prop-2-enylspiro[3,5,6-trihydrobenzo[h]quinazoli ne-5,1'-cyclopentane]-4-one|3-allyl-2-((2-oxo-2-phenylethyl)thio)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
| Molecular Formula | C27H26N2O2S |
|---|---|
| Molecular Weight | 442.1715 g/mol |
| LogP | 5.4392 |
| Topological Polar Surface Area | 51.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 442.1715 |
| Monoisotopic Mass | 442.1715 |
| Heavy Atoms | 32 |
| Complexity | 1240.2563 |
Chemical Identifiers
| CAS Number | 337495-75-7 |
|---|---|
| SMILES | C=CCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCC4)N=C1SCC(=O)C5=CC=CC=C5 |
Product Overview
AC1MJ2EB (CAS 337495-75-7), with molecular formula C27H26N2O2S and molecular weight 442.1715 g/mol. IUPAC: 2-phenacylsulfanyl-3-prop-2-enylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one.