1-{4-[(4-ethoxy-3-methoxyphenyl)methyl]-7-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl}ethan-1-one
Chemical Structure Depiction of
1-{4-[(4-ethoxy-3-methoxyphenyl)methyl]-7-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl}ethan-1-one
1-{4-[(4-ethoxy-3-methoxyphenyl)methyl]-7-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | S990-0523 |
| Compound Name: | 1-{4-[(4-ethoxy-3-methoxyphenyl)methyl]-7-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl}ethan-1-one |
| Molecular Weight: | 388.47 |
| Molecular Formula: | C20 H28 N4 O4 |
| Smiles: | CCOc1ccc(CN2CCC(c3nc(C)no3)N(CC2)C(C)=O)cc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4999 |
| logD: | 0.4842 |
| logSw: | -2.1131 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.322 |
| InChI Key: | GOGPFJUKSCILCH-KRWDZBQOSA-N |