N~2~-(3-chlorophenyl)-N~5~-[(3,4,5-trimethoxyphenyl)methyl]-1,3,4-thiadiazole-2,5-dicarboxamide
Chemical Structure Depiction of
N~2~-(3-chlorophenyl)-N~5~-[(3,4,5-trimethoxyphenyl)methyl]-1,3,4-thiadiazole-2,5-dicarboxamide
N~2~-(3-chlorophenyl)-N~5~-[(3,4,5-trimethoxyphenyl)methyl]-1,3,4-thiadiazole-2,5-dicarboxamide
Compound characteristics
| Compound ID: | G675-1223 |
| Compound Name: | N~2~-(3-chlorophenyl)-N~5~-[(3,4,5-trimethoxyphenyl)methyl]-1,3,4-thiadiazole-2,5-dicarboxamide |
| Molecular Weight: | 462.91 |
| Molecular Formula: | C20 H19 Cl N4 O5 S |
| Smiles: | COc1cc(CNC(c2nnc(C(Nc3cccc(c3)[Cl])=O)s2)=O)cc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 3.2167 |
| logD: | 3.1636 |
| logSw: | -3.6123 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.225 |
| InChI Key: | PFYYJWFQEMMIGP-UHFFFAOYSA-N |