N-[3-(azepan-1-yl)butyl]-5-(3,5-dimethyl-1-benzofuran-2-yl)-1,3,4-oxadiazole-2-carboxamide
Chemical Structure Depiction of
N-[3-(azepan-1-yl)butyl]-5-(3,5-dimethyl-1-benzofuran-2-yl)-1,3,4-oxadiazole-2-carboxamide
N-[3-(azepan-1-yl)butyl]-5-(3,5-dimethyl-1-benzofuran-2-yl)-1,3,4-oxadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F953-1132 |
| Compound Name: | N-[3-(azepan-1-yl)butyl]-5-(3,5-dimethyl-1-benzofuran-2-yl)-1,3,4-oxadiazole-2-carboxamide |
| Molecular Weight: | 410.52 |
| Molecular Formula: | C23 H30 N4 O3 |
| Smiles: | CC(CCNC(c1nnc(c2c(C)c3cc(C)ccc3o2)o1)=O)N1CCCCCC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.82 |
| logD: | 0.8876 |
| logSw: | -3.8154 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.507 |
| InChI Key: | GRRJVWZQMFGWDJ-INIZCTEOSA-N |