2-(2-nitrophenyl)-N-[5-(pentan-3-yl)-1,3,4-thiadiazol-2-yl]acetamide
Chemical Structure Depiction of
2-(2-nitrophenyl)-N-[5-(pentan-3-yl)-1,3,4-thiadiazol-2-yl]acetamide
2-(2-nitrophenyl)-N-[5-(pentan-3-yl)-1,3,4-thiadiazol-2-yl]acetamide
Compound characteristics
| Compound ID: | Y032-3387 |
| Compound Name: | 2-(2-nitrophenyl)-N-[5-(pentan-3-yl)-1,3,4-thiadiazol-2-yl]acetamide |
| Molecular Weight: | 334.39 |
| Molecular Formula: | C15 H18 N4 O3 S |
| Smiles: | CCC(CC)c1nnc(NC(Cc2ccccc2[N+]([O-])=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.9993 |
| logD: | 3.8643 |
| logSw: | -4.0808 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.742 |
| InChI Key: | JMPPCJRGCSBKMF-UHFFFAOYSA-N |