N-[(4-chlorophenyl)methyl]-2-(4-methylpiperidin-1-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-2-(4-methylpiperidin-1-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
N-[(4-chlorophenyl)methyl]-2-(4-methylpiperidin-1-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Compound characteristics
Compound ID: | G205-0324 |
Compound Name: | N-[(4-chlorophenyl)methyl]-2-(4-methylpiperidin-1-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide |
Molecular Weight: | 417.92 |
Molecular Formula: | C19 H20 Cl N5 O2 S |
Smiles: | CC1CCN(CC1)C1=NN2C(=NC=C(C(NCc3ccc(cc3)[Cl])=O)C2=O)S1 |
Stereo: | ACHIRAL |
logP: | 2.986 |
logD: | 2.7167 |
logSw: | -3.6496 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.24 |
InChI Key: | ATNSFQXCKYGAHH-UHFFFAOYSA-N |