N-(2-bromophenyl)-4-(3-methyl-5-oxo-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)butanamide
Chemical Structure Depiction of
N-(2-bromophenyl)-4-(3-methyl-5-oxo-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)butanamide
N-(2-bromophenyl)-4-(3-methyl-5-oxo-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)butanamide
Compound characteristics
Compound ID: | G279-1020 |
Compound Name: | N-(2-bromophenyl)-4-(3-methyl-5-oxo-1-phenyl-5,6-dihydropyrazolo[3,4-b][1,4]thiazin-4(1H)-yl)butanamide |
Molecular Weight: | 485.4 |
Molecular Formula: | C22 H21 Br N4 O2 S |
Smiles: | Cc1c2c(n(c3ccccc3)n1)SCC(N2CCCC(Nc1ccccc1[Br])=O)=O |
Stereo: | ACHIRAL |
logP: | 3.0097 |
logD: | 3.0097 |
logSw: | -3.367 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.998 |
InChI Key: | ZZZRZFWJPLOQKQ-UHFFFAOYSA-N |