N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-nonylbenzamide
Chemical Structure Depiction of
N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-nonylbenzamide
N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-nonylbenzamide
Compound characteristics
| Compound ID: | 0938-8102 |
| Compound Name: | N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-nonylbenzamide |
| Molecular Weight: | 391.6 |
| Molecular Formula: | C20 H29 N3 O S2 |
| Smiles: | CCCCCCCCCc1ccc(cc1)C(Nc1nnc(SCC)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.9709 |
| logD: | 7.874 |
| logSw: | -5.712 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.236 |
| InChI Key: | BCNWLIDAPBUHAW-UHFFFAOYSA-N |