N-{2-[(4-chlorophenyl)sulfanyl]-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)phenyl}acetamide
Chemical Structure Depiction of
N-{2-[(4-chlorophenyl)sulfanyl]-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)phenyl}acetamide
N-{2-[(4-chlorophenyl)sulfanyl]-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)phenyl}acetamide
Compound characteristics
| Compound ID: | K786-2921 |
| Compound Name: | N-{2-[(4-chlorophenyl)sulfanyl]-5-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)phenyl}acetamide |
| Molecular Weight: | 446.95 |
| Molecular Formula: | C22 H23 Cl N2 O4 S |
| Smiles: | CC(Nc1cc(ccc1Sc1ccc(cc1)[Cl])C(N1CCC2(CC1)OCCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9893 |
| logD: | 2.9893 |
| logSw: | -3.6914 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.616 |
| InChI Key: | CRALBXGAGMFNPK-UHFFFAOYSA-N |