3-(cyclopentylmethyl)-2-sulfanylidene-2,3-dihydro-1H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Chemical Structure Depiction of
3-(cyclopentylmethyl)-2-sulfanylidene-2,3-dihydro-1H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
3-(cyclopentylmethyl)-2-sulfanylidene-2,3-dihydro-1H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Compound characteristics
| Compound ID: | 4164-0096 |
| Compound Name: | 3-(cyclopentylmethyl)-2-sulfanylidene-2,3-dihydro-1H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one |
| Molecular Weight: | 380.55 |
| Molecular Formula: | C23 H28 N2 O S |
| Smiles: | C1CCC2(CC1)Cc1ccccc1C1=C2C(N(CC2CCCC2)C(N1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2958 |
| logD: | 5.2567 |
| logSw: | -5.4333 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.6541 |
| InChI Key: | OAHYWVXRCNQVPS-UHFFFAOYSA-N |