5-[(4-methylphenoxy)methyl]-N-{3-[(3-phenylpropyl)carbamoyl]phenyl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[(4-methylphenoxy)methyl]-N-{3-[(3-phenylpropyl)carbamoyl]phenyl}-1,3,4-thiadiazole-2-carboxamide
5-[(4-methylphenoxy)methyl]-N-{3-[(3-phenylpropyl)carbamoyl]phenyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F912-1066 |
| Compound Name: | 5-[(4-methylphenoxy)methyl]-N-{3-[(3-phenylpropyl)carbamoyl]phenyl}-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 486.59 |
| Molecular Formula: | C27 H26 N4 O3 S |
| Smiles: | Cc1ccc(cc1)OCc1nnc(C(Nc2cccc(c2)C(NCCCc2ccccc2)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.4107 |
| logD: | 5.4106 |
| logSw: | -5.2948 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.811 |
| InChI Key: | DMKOMEMSZFXIGU-UHFFFAOYSA-N |