tert-butyl (2S)-2-(5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl (2S)-2-(5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate
tert-butyl (2S)-2-(5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate
Compound characteristics
| Compound ID: | 8388-0168 |
| Compound Name: | tert-butyl (2S)-2-(5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-1,3,4-oxadiazol-2-yl)pyrrolidine-1-carboxylate |
| Molecular Weight: | 387.5 |
| Molecular Formula: | C20 H25 N3 O3 S |
| Smiles: | CC(C)(C)OC(N1CCC[C@H]1c1nnc(o1)SC/C=C/c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4301 |
| logD: | 4.4301 |
| logSw: | -4.2832 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.206 |
| InChI Key: | PCKCLAQSWPIHIX-INIZCTEOSA-N |