N-[5-(oxolan-2-yl)-1,3,4-thiadiazol-2-yl]-Nalpha-(thiomorpholine-4-carbonyl)phenylalaninamide
Chemical Structure Depiction of
N-[5-(oxolan-2-yl)-1,3,4-thiadiazol-2-yl]-Nalpha-(thiomorpholine-4-carbonyl)phenylalaninamide
N-[5-(oxolan-2-yl)-1,3,4-thiadiazol-2-yl]-Nalpha-(thiomorpholine-4-carbonyl)phenylalaninamide
Compound characteristics
| Compound ID: | Y043-7551 |
| Compound Name: | N-[5-(oxolan-2-yl)-1,3,4-thiadiazol-2-yl]-Nalpha-(thiomorpholine-4-carbonyl)phenylalaninamide |
| Molecular Weight: | 447.58 |
| Molecular Formula: | C20 H25 N5 O3 S2 |
| Smiles: | C1CC(c2nnc(NC([C@H](Cc3ccccc3)NC(N3CCSCC3)=O)=O)s2)OC1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.4902 |
| logD: | 2.3262 |
| logSw: | -2.7827 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.437 |
| InChI Key: | HRBKTQUEPKYOCC-VYRBHSGPSA-N |