3-nitro-N-[5-(2-phenylethyl)-1,3,4-thiadiazol-2-yl]benzamide
Chemical Structure Depiction of
3-nitro-N-[5-(2-phenylethyl)-1,3,4-thiadiazol-2-yl]benzamide
3-nitro-N-[5-(2-phenylethyl)-1,3,4-thiadiazol-2-yl]benzamide
Compound characteristics
| Compound ID: | 8006-8436 |
| Compound Name: | 3-nitro-N-[5-(2-phenylethyl)-1,3,4-thiadiazol-2-yl]benzamide |
| Molecular Weight: | 354.39 |
| Molecular Formula: | C17 H14 N4 O3 S |
| Smiles: | C(Cc1nnc(NC(c2cccc(c2)[N+]([O-])=O)=O)s1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2094 |
| logD: | 2.4328 |
| logSw: | -4.4509 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.48 |
| InChI Key: | RDWCWIPRQNXTMI-UHFFFAOYSA-N |