3-[(furan-2-yl)methyl]-2-sulfanylidene-2,3-dihydro-1H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Chemical Structure Depiction of
3-[(furan-2-yl)methyl]-2-sulfanylidene-2,3-dihydro-1H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
3-[(furan-2-yl)methyl]-2-sulfanylidene-2,3-dihydro-1H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Compound characteristics
| Compound ID: | 5218-3262 |
| Compound Name: | 3-[(furan-2-yl)methyl]-2-sulfanylidene-2,3-dihydro-1H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one |
| Molecular Weight: | 378.49 |
| Molecular Formula: | C22 H22 N2 O2 S |
| Smiles: | C1CCC2(CC1)Cc1ccccc1C1=C2C(N(Cc2ccco2)C(N1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4693 |
| logD: | 4.4512 |
| logSw: | -4.3667 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.845 |
| InChI Key: | RUPPYUHZANZJAI-UHFFFAOYSA-N |