N-[5-(4-bromophenyl)-6H-1,3,4-thiadiazin-2-yl]-2-(phenylsulfanyl)butanamide
Chemical Structure Depiction of
N-[5-(4-bromophenyl)-6H-1,3,4-thiadiazin-2-yl]-2-(phenylsulfanyl)butanamide
N-[5-(4-bromophenyl)-6H-1,3,4-thiadiazin-2-yl]-2-(phenylsulfanyl)butanamide
Compound characteristics
| Compound ID: | D026-0065 |
| Compound Name: | N-[5-(4-bromophenyl)-6H-1,3,4-thiadiazin-2-yl]-2-(phenylsulfanyl)butanamide |
| Molecular Weight: | 448.4 |
| Molecular Formula: | C19 H18 Br N3 O S2 |
| Smiles: | CCC(C(NC1=NN=C(CS1)c1ccc(cc1)[Br])=O)Sc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8008 |
| logD: | 5.7999 |
| logSw: | -5.5932 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.013 |
| InChI Key: | ZNVNQIJSJMBVIR-KRWDZBQOSA-N |