N-[(2-bromophenyl)methyl]-5-oxo-2-(piperidin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-[(2-bromophenyl)methyl]-5-oxo-2-(piperidin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
N-[(2-bromophenyl)methyl]-5-oxo-2-(piperidin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Compound characteristics
Compound ID: | G205-0160 |
Compound Name: | N-[(2-bromophenyl)methyl]-5-oxo-2-(piperidin-1-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide |
Molecular Weight: | 448.34 |
Molecular Formula: | C18 H18 Br N5 O2 S |
Smiles: | C1CCN(CC1)C1=NN2C(=NC=C(C(NCc3ccccc3[Br])=O)C2=O)S1 |
Stereo: | ACHIRAL |
logP: | 2.9329 |
logD: | 2.8099 |
logSw: | -3.2665 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.24 |
InChI Key: | TWJHEJUZUHBLHR-UHFFFAOYSA-N |