1-(benzylsulfanyl)-3,3-dimethyl-2-azaspiro[5.5]undeca-1,7,10-trien-9-one
Chemical Structure Depiction of
1-(benzylsulfanyl)-3,3-dimethyl-2-azaspiro[5.5]undeca-1,7,10-trien-9-one
1-(benzylsulfanyl)-3,3-dimethyl-2-azaspiro[5.5]undeca-1,7,10-trien-9-one
Compound characteristics
| Compound ID: | 7174-0017 |
| Compound Name: | 1-(benzylsulfanyl)-3,3-dimethyl-2-azaspiro[5.5]undeca-1,7,10-trien-9-one |
| Molecular Weight: | 311.44 |
| Molecular Formula: | C19 H21 N O S |
| Smiles: | CC1(C)CCC2(C=CC(C=C2)=O)C(=N1)SCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.8019 |
| logD: | 1.1627 |
| logSw: | -2.9967 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 21.8001 |
| InChI Key: | NQVRYRIBBUJAHI-UHFFFAOYSA-N |