1-[4-(2-ethylbenzene-1-sulfonyl)-7-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]ethan-1-one
Chemical Structure Depiction of
1-[4-(2-ethylbenzene-1-sulfonyl)-7-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]ethan-1-one
1-[4-(2-ethylbenzene-1-sulfonyl)-7-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | S990-0604 |
| Compound Name: | 1-[4-(2-ethylbenzene-1-sulfonyl)-7-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]ethan-1-one |
| Molecular Weight: | 392.48 |
| Molecular Formula: | C18 H24 N4 O4 S |
| Smiles: | CCc1ccccc1S(N1CCC(c2nc(C)no2)N(CC1)C(C)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9662 |
| logD: | 1.9662 |
| logSw: | -2.2887 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.46 |
| InChI Key: | AHPLHIDDDWOMGV-MRXNPFEDSA-N |