N-[5-(4-bromophenyl)-6H-1,3,4-thiadiazin-2-yl]-2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]butanamide
Chemical Structure Depiction of
N-[5-(4-bromophenyl)-6H-1,3,4-thiadiazin-2-yl]-2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]butanamide
N-[5-(4-bromophenyl)-6H-1,3,4-thiadiazin-2-yl]-2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]butanamide
Compound characteristics
| Compound ID: | D026-0071 |
| Compound Name: | N-[5-(4-bromophenyl)-6H-1,3,4-thiadiazin-2-yl]-2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]butanamide |
| Molecular Weight: | 478.43 |
| Molecular Formula: | C19 H20 Br N5 O S2 |
| Smiles: | CCC(C(NC1=NN=C(CS1)c1ccc(cc1)[Br])=O)Sc1nc(C)cc(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1063 |
| logD: | 5.1057 |
| logSw: | -4.9333 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.919 |
| InChI Key: | AHSNHMBWAUBQQA-INIZCTEOSA-N |