3-nitro-N-[5-(2-phenylpropyl)-1,3,4-thiadiazol-2-yl]benzamide
Chemical Structure Depiction of
3-nitro-N-[5-(2-phenylpropyl)-1,3,4-thiadiazol-2-yl]benzamide
3-nitro-N-[5-(2-phenylpropyl)-1,3,4-thiadiazol-2-yl]benzamide
Compound characteristics
| Compound ID: | Y032-4129 |
| Compound Name: | 3-nitro-N-[5-(2-phenylpropyl)-1,3,4-thiadiazol-2-yl]benzamide |
| Molecular Weight: | 368.41 |
| Molecular Formula: | C18 H16 N4 O3 S |
| Smiles: | CC(Cc1nnc(NC(c2cccc(c2)[N+]([O-])=O)=O)s1)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7879 |
| logD: | 3.0112 |
| logSw: | -4.5797 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.48 |
| InChI Key: | ZHCUWPJFKRGWGA-LBPRGKRZSA-N |