5-[(2-methylphenoxy)methyl]-N-[4-(4-propylpiperazine-1-carbonyl)phenyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[(2-methylphenoxy)methyl]-N-[4-(4-propylpiperazine-1-carbonyl)phenyl]-1,3,4-thiadiazole-2-carboxamide
5-[(2-methylphenoxy)methyl]-N-[4-(4-propylpiperazine-1-carbonyl)phenyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F913-0356 |
| Compound Name: | 5-[(2-methylphenoxy)methyl]-N-[4-(4-propylpiperazine-1-carbonyl)phenyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 479.6 |
| Molecular Formula: | C25 H29 N5 O3 S |
| Smiles: | CCCN1CCN(CC1)C(c1ccc(cc1)NC(c1nnc(COc2ccccc2C)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2966 |
| logD: | 3.1074 |
| logSw: | -3.5251 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.082 |
| InChI Key: | CMHABYVWXLRYOI-UHFFFAOYSA-N |