N-[2-(cyclohex-1-en-1-yl)ethyl]-3-[2-(4-methylbenzene-1-sulfonyl)ethyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-3-[2-(4-methylbenzene-1-sulfonyl)ethyl]-1,2,4-oxadiazole-5-carboxamide
N-[2-(cyclohex-1-en-1-yl)ethyl]-3-[2-(4-methylbenzene-1-sulfonyl)ethyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | M027-0328 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-3-[2-(4-methylbenzene-1-sulfonyl)ethyl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 403.5 |
| Molecular Formula: | C20 H25 N3 O4 S |
| Smiles: | Cc1ccc(cc1)S(CCc1nc(C(NCCC2CCCCC=2)=O)on1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8242 |
| logD: | 2.8242 |
| logSw: | -3.4911 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.39 |
| InChI Key: | BNTYGMQHGURPEA-UHFFFAOYSA-N |