9-(3-phenyl-1,2,4-oxadiazol-5-yl)-5-(propane-1-sulfonyl)-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
9-(3-phenyl-1,2,4-oxadiazol-5-yl)-5-(propane-1-sulfonyl)-1,5-diazacycloundecan-2-one
9-(3-phenyl-1,2,4-oxadiazol-5-yl)-5-(propane-1-sulfonyl)-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S747-0546 |
| Compound Name: | 9-(3-phenyl-1,2,4-oxadiazol-5-yl)-5-(propane-1-sulfonyl)-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 420.53 |
| Molecular Formula: | C20 H28 N4 O4 S |
| Smiles: | CCCS(N1CCCC(CCNC(CC1)=O)c1nc(c2ccccc2)no1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2368 |
| logD: | 2.2368 |
| logSw: | -2.6406 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.876 |
| InChI Key: | VRUNUCMEAKFVQM-KRWDZBQOSA-N |