N-[5-(4-bromophenyl)-6H-1,3,4-thiadiazin-2-yl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]butanamide
Chemical Structure Depiction of
N-[5-(4-bromophenyl)-6H-1,3,4-thiadiazin-2-yl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]butanamide
N-[5-(4-bromophenyl)-6H-1,3,4-thiadiazin-2-yl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]butanamide
Compound characteristics
| Compound ID: | D026-0067 |
| Compound Name: | N-[5-(4-bromophenyl)-6H-1,3,4-thiadiazin-2-yl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]butanamide |
| Molecular Weight: | 516.44 |
| Molecular Formula: | C20 H18 Br N7 O S2 |
| Smiles: | CCC(C(NC1=NN=C(CS1)c1ccc(cc1)[Br])=O)Sc1nnnn1c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1807 |
| logD: | 5.1801 |
| logSw: | -5.0521 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.935 |
| InChI Key: | MBAZGSBCCVBHFX-KRWDZBQOSA-N |