1-[4-acetyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]-3-(benzenesulfonyl)propan-1-one
Chemical Structure Depiction of
1-[4-acetyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]-3-(benzenesulfonyl)propan-1-one
1-[4-acetyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]-3-(benzenesulfonyl)propan-1-one
Compound characteristics
| Compound ID: | S990-0517 |
| Compound Name: | 1-[4-acetyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1,4-diazepan-1-yl]-3-(benzenesulfonyl)propan-1-one |
| Molecular Weight: | 420.49 |
| Molecular Formula: | C19 H24 N4 O5 S |
| Smiles: | CC(N1CCN(CCC1c1nc(C)no1)C(CCS(c1ccccc1)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.1767 |
| logD: | 0.1767 |
| logSw: | -2.0208 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 93.906 |
| InChI Key: | MQMMZJLEHHGRQO-QGZVFWFLSA-N |