5-[(3,4-dimethoxyphenoxy)methyl]-N-(4-{[(4-methylphenyl)methyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[(3,4-dimethoxyphenoxy)methyl]-N-(4-{[(4-methylphenyl)methyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide
5-[(3,4-dimethoxyphenoxy)methyl]-N-(4-{[(4-methylphenyl)methyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F913-0763 |
| Compound Name: | 5-[(3,4-dimethoxyphenoxy)methyl]-N-(4-{[(4-methylphenyl)methyl]carbamoyl}phenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 518.59 |
| Molecular Formula: | C27 H26 N4 O5 S |
| Smiles: | Cc1ccc(CNC(c2ccc(cc2)NC(c2nnc(COc3ccc(c(c3)OC)OC)s2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.6374 |
| logD: | 3.6307 |
| logSw: | -3.9615 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.231 |
| InChI Key: | ZSJKFUKVKVILIX-UHFFFAOYSA-N |