AC1LYRGC
3-[(4-methoxyphenyl)methyl]-2-propan-2-ylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one
Also Known As: Oprea1_263529|Oprea1_804698|BAS 01322162|3-(4-methoxybenzyl)-2-(propan-2-ylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one|2-(isopropylthio)-3-(4-methoxybenzyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one|3-[(4-methoxyphenyl)methyl]-2-(methylethylthio)spiro[3,5,6-trihydrobenzo[h]qui nazoline-5,1'-cyclohexane]-4-one|3-[(4-methoxyphenyl)methyl]-2-propan-2-ylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one
| Molecular Formula | C28H32N2O2S |
|---|---|
| Molecular Weight | 460.21844 g/mol |
| LogP | 6.2257 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 460.21844 |
| Monoisotopic Mass | 460.21844 |
| Heavy Atoms | 33 |
| Complexity | 1207.5573 |
Chemical Identifiers
| CAS Number | 337495-64-4 |
|---|---|
| SMILES | CC(C)SC1=NC2=C(C(=O)N1CC3=CC=C(C=C3)OC)C4(CCCCC4)CC5=CC=CC=C52 |
Product Overview
AC1LYRGC (CAS 337495-64-4), with molecular formula C28H32N2O2S and molecular weight 460.21844 g/mol. IUPAC: 3-[(4-methoxyphenyl)methyl]-2-propan-2-ylsulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one.
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