N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-tert-butylbenzamide
Chemical Structure Depiction of
N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-tert-butylbenzamide
N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-tert-butylbenzamide
Compound characteristics
| Compound ID: | V012-0516 |
| Compound Name: | N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-tert-butylbenzamide |
| Molecular Weight: | 383.53 |
| Molecular Formula: | C20 H21 N3 O S2 |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1ccc(cc1)C(Nc1nnc(SCc2ccccc2)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0065 |
| logD: | 5.9503 |
| logSw: | -5.5493 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.964 |
| InChI Key: | SNTDJQOTJVIGHE-UHFFFAOYSA-N |