3-nitro-N-[5-(pyrrolidine-1-sulfonyl)-1,3,4-thiadiazol-2-yl]benzamide
Chemical Structure Depiction of
3-nitro-N-[5-(pyrrolidine-1-sulfonyl)-1,3,4-thiadiazol-2-yl]benzamide
3-nitro-N-[5-(pyrrolidine-1-sulfonyl)-1,3,4-thiadiazol-2-yl]benzamide
Compound characteristics
| Compound ID: | E157-1145 |
| Compound Name: | 3-nitro-N-[5-(pyrrolidine-1-sulfonyl)-1,3,4-thiadiazol-2-yl]benzamide |
| Molecular Weight: | 383.4 |
| Molecular Formula: | C13 H13 N5 O5 S2 |
| Smiles: | C1CCN(C1)S(c1nnc(NC(c2cccc(c2)[N+]([O-])=O)=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3084 |
| logD: | -0.4328 |
| logSw: | -3.032 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 112.108 |
| InChI Key: | GJDAUOCFTWXPFT-UHFFFAOYSA-N |