N-[5-(3,4-dihydroquinoline-1(2H)-sulfonyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide
Chemical Structure Depiction of
N-[5-(3,4-dihydroquinoline-1(2H)-sulfonyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide
N-[5-(3,4-dihydroquinoline-1(2H)-sulfonyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide
Compound characteristics
| Compound ID: | E157-2665 |
| Compound Name: | N-[5-(3,4-dihydroquinoline-1(2H)-sulfonyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide |
| Molecular Weight: | 445.47 |
| Molecular Formula: | C18 H15 N5 O5 S2 |
| Smiles: | C1Cc2ccccc2N(C1)S(c1nnc(NC(c2cccc(c2)[N+]([O-])=O)=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4702 |
| logD: | 0.9666 |
| logSw: | -3.8787 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 111.183 |
| InChI Key: | PNGDSFQPEKCXAN-UHFFFAOYSA-N |