N-[5-({[(3-methylphenyl)methyl]sulfanyl}methyl)-1,3,4-thiadiazol-2-yl]-3-phenylprop-2-enamide
Chemical Structure Depiction of
N-[5-({[(3-methylphenyl)methyl]sulfanyl}methyl)-1,3,4-thiadiazol-2-yl]-3-phenylprop-2-enamide
N-[5-({[(3-methylphenyl)methyl]sulfanyl}methyl)-1,3,4-thiadiazol-2-yl]-3-phenylprop-2-enamide
Compound characteristics
| Compound ID: | 3202-0008 |
| Compound Name: | N-[5-({[(3-methylphenyl)methyl]sulfanyl}methyl)-1,3,4-thiadiazol-2-yl]-3-phenylprop-2-enamide |
| Molecular Weight: | 381.52 |
| Molecular Formula: | C20 H19 N3 O S2 |
| Smiles: | Cc1cccc(CSCc2nnc(NC(/C=C/c3ccccc3)=O)s2)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.8991 |
| logD: | 5.8336 |
| logSw: | -5.4713 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.885 |
| InChI Key: | SARNFMPILXCMJJ-UHFFFAOYSA-N |