N-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-[4-(3-phenylprop-2-enoyl)piperazin-1-yl]acetamide
Chemical Structure Depiction of
N-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-[4-(3-phenylprop-2-enoyl)piperazin-1-yl]acetamide
N-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-[4-(3-phenylprop-2-enoyl)piperazin-1-yl]acetamide
Compound characteristics
| Compound ID: | L341-0231 |
| Compound Name: | N-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-[4-(3-phenylprop-2-enoyl)piperazin-1-yl]acetamide |
| Molecular Weight: | 447.56 |
| Molecular Formula: | C24 H25 N5 O2 S |
| Smiles: | Cc1ccccc1c1nnc(NC(CN2CCN(CC2)C(/C=C/c2ccccc2)=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.1357 |
| logD: | 4.1356 |
| logSw: | -4.1484 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.323 |
| InChI Key: | MQGSUPMTWKLPGT-UHFFFAOYSA-N |