2-(azepan-1-yl)-5-oxo-N-[(pyridin-2-yl)methyl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
2-(azepan-1-yl)-5-oxo-N-[(pyridin-2-yl)methyl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
2-(azepan-1-yl)-5-oxo-N-[(pyridin-2-yl)methyl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide
Compound characteristics
Compound ID: | G205-1073 |
Compound Name: | 2-(azepan-1-yl)-5-oxo-N-[(pyridin-2-yl)methyl]-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidine-6-carboxamide |
Molecular Weight: | 384.46 |
Molecular Formula: | C18 H20 N6 O2 S |
Smiles: | C1CCCN(CC1)C1=NN2C(=NC=C(C(NCc3ccccn3)=O)C2=O)S1 |
Stereo: | ACHIRAL |
logP: | 1.647 |
logD: | 1.4669 |
logSw: | -2.331 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 75.114 |
InChI Key: | SMRCBHCRUXXQHP-UHFFFAOYSA-N |