N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-phenoxybenzamide
Chemical Structure Depiction of
N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-phenoxybenzamide
N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-phenoxybenzamide
Compound characteristics
| Compound ID: | Y030-8846 |
| Compound Name: | N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-phenoxybenzamide |
| Molecular Weight: | 447.51 |
| Molecular Formula: | C24 H21 N3 O4 S |
| Smiles: | COc1ccc(Cc2nnc(NC(c3ccccc3Oc3ccccc3)=O)s2)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.8223 |
| logD: | 4.372 |
| logSw: | -4.6691 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.193 |
| InChI Key: | LFVGDHDHXDYEMJ-UHFFFAOYSA-N |