2-(butylsulfanyl)-3-ethyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Chemical Structure Depiction of
2-(butylsulfanyl)-3-ethyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
2-(butylsulfanyl)-3-ethyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Compound characteristics
| Compound ID: | 4222-0121 |
| Compound Name: | 2-(butylsulfanyl)-3-ethyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one |
| Molecular Weight: | 368.54 |
| Molecular Formula: | C22 H28 N2 O S |
| Smiles: | CCCCSC1=NC2=C(C(N1CC)=O)C1(CCCC1)Cc1ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 5.598 |
| logD: | 5.598 |
| logSw: | -5.3301 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.1829 |
| InChI Key: | UNKROYKHAKNQQM-UHFFFAOYSA-N |