3-ethyl-2-sulfanylidene-2,3-dihydro-1H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Chemical Structure Depiction of
3-ethyl-2-sulfanylidene-2,3-dihydro-1H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
3-ethyl-2-sulfanylidene-2,3-dihydro-1H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Compound characteristics
| Compound ID: | 4222-0150 |
| Compound Name: | 3-ethyl-2-sulfanylidene-2,3-dihydro-1H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one |
| Molecular Weight: | 312.43 |
| Molecular Formula: | C18 H20 N2 O S |
| Smiles: | CCN1C(C2=C(c3ccccc3CC23CCCC3)NC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4751 |
| logD: | 3.4361 |
| logSw: | -3.6623 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.4583 |
| InChI Key: | PVEGLRIYLCWVKZ-UHFFFAOYSA-N |