5-[(5-methylthiophen-2-yl)methyl]-9-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
5-[(5-methylthiophen-2-yl)methyl]-9-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecan-2-one
5-[(5-methylthiophen-2-yl)methyl]-9-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S747-0160 |
| Compound Name: | 5-[(5-methylthiophen-2-yl)methyl]-9-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 390.55 |
| Molecular Formula: | C20 H30 N4 O2 S |
| Smiles: | CC(C)c1nc(C2CCCN(CCC(NCC2)=O)Cc2ccc(C)s2)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0395 |
| logD: | 1.7203 |
| logSw: | -3.1862 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.021 |
| InChI Key: | MLULHWVMSDCOBV-INIZCTEOSA-N |