5-(3-methoxybenzene-1-sulfonyl)-9-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
5-(3-methoxybenzene-1-sulfonyl)-9-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecan-2-one
5-(3-methoxybenzene-1-sulfonyl)-9-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S747-0255 |
| Compound Name: | 5-(3-methoxybenzene-1-sulfonyl)-9-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 450.56 |
| Molecular Formula: | C21 H30 N4 O5 S |
| Smiles: | CC(C)c1nc(C2CCCN(CCC(NCC2)=O)S(c2cccc(c2)OC)(=O)=O)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3268 |
| logD: | 2.3268 |
| logSw: | -2.9325 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.525 |
| InChI Key: | GKDYXRHSWZEPTA-INIZCTEOSA-N |