N-(4-{[2-(dimethylamino)ethyl]carbamoyl}phenyl)-5-[(2-methylphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-{[2-(dimethylamino)ethyl]carbamoyl}phenyl)-5-[(2-methylphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
N-(4-{[2-(dimethylamino)ethyl]carbamoyl}phenyl)-5-[(2-methylphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F913-0320 |
| Compound Name: | N-(4-{[2-(dimethylamino)ethyl]carbamoyl}phenyl)-5-[(2-methylphenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 439.54 |
| Molecular Formula: | C22 H25 N5 O3 S |
| Smiles: | Cc1ccccc1OCc1nnc(C(Nc2ccc(cc2)C(NCCN(C)C)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.587 |
| logD: | 1.7477 |
| logSw: | -3.0844 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.035 |
| InChI Key: | RYGKBHYGSHYOIV-UHFFFAOYSA-N |