2-sulfanylidene-2,3-dihydro-1H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Chemical Structure Depiction of
2-sulfanylidene-2,3-dihydro-1H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
2-sulfanylidene-2,3-dihydro-1H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Compound characteristics
| Compound ID: | 8004-6607 |
| Compound Name: | 2-sulfanylidene-2,3-dihydro-1H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one |
| Molecular Weight: | 298.4 |
| Molecular Formula: | C17 H18 N2 O S |
| Smiles: | C1CCC2(CC1)Cc1ccccc1C1=C2C(NC(N1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5535 |
| logD: | 3.3499 |
| logSw: | -3.7777 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 35.882 |
| InChI Key: | GTDBGPWZNPZTJR-UHFFFAOYSA-N |