3-[4-(azepane-1-sulfonyl)phenyl]-N-[(1-ethylpyrrolidin-2-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
3-[4-(azepane-1-sulfonyl)phenyl]-N-[(1-ethylpyrrolidin-2-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
3-[4-(azepane-1-sulfonyl)phenyl]-N-[(1-ethylpyrrolidin-2-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | L307-1721 |
| Compound Name: | 3-[4-(azepane-1-sulfonyl)phenyl]-N-[(1-ethylpyrrolidin-2-yl)methyl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 461.58 |
| Molecular Formula: | C22 H31 N5 O4 S |
| Smiles: | CCN1CCCC1CNC(c1nc(c2ccc(cc2)S(N2CCCCCC2)(=O)=O)no1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8465 |
| logD: | 1.7581 |
| logSw: | -3.4167 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.278 |
| InChI Key: | VDSVLUHQEDPPKQ-GOSISDBHSA-N |