N-(5-benzyl-1,3,4-thiadiazol-2-yl)-4-phenyloxane-4-carboxamide
Chemical Structure Depiction of
N-(5-benzyl-1,3,4-thiadiazol-2-yl)-4-phenyloxane-4-carboxamide
N-(5-benzyl-1,3,4-thiadiazol-2-yl)-4-phenyloxane-4-carboxamide
Compound characteristics
| Compound ID: | Y042-5163 |
| Compound Name: | N-(5-benzyl-1,3,4-thiadiazol-2-yl)-4-phenyloxane-4-carboxamide |
| Molecular Weight: | 379.48 |
| Molecular Formula: | C21 H21 N3 O2 S |
| Smiles: | C(c1ccccc1)c1nnc(NC(C2(CCOCC2)c2ccccc2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.3514 |
| logD: | 4.0408 |
| logSw: | -4.3932 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.927 |
| InChI Key: | RQYRDRNBVCTFMR-UHFFFAOYSA-N |