N-[5-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2-(4-methylbenzene-1-sulfonyl)phenyl]propanamide
Chemical Structure Depiction of
N-[5-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2-(4-methylbenzene-1-sulfonyl)phenyl]propanamide
N-[5-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2-(4-methylbenzene-1-sulfonyl)phenyl]propanamide
Compound characteristics
| Compound ID: | K788-0353 |
| Compound Name: | N-[5-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-2-(4-methylbenzene-1-sulfonyl)phenyl]propanamide |
| Molecular Weight: | 472.56 |
| Molecular Formula: | C24 H28 N2 O6 S |
| Smiles: | CCC(Nc1cc(ccc1S(c1ccc(C)cc1)(=O)=O)C(N1CCC2(CC1)OCCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1913 |
| logD: | 2.1913 |
| logSw: | -2.9073 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.276 |
| InChI Key: | BNBAHMNHDCVIPC-UHFFFAOYSA-N |