ethyl (4-{[(5-oxo-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]carbamamido}phenyl)acetate
Chemical Structure Depiction of
ethyl (4-{[(5-oxo-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]carbamamido}phenyl)acetate
ethyl (4-{[(5-oxo-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]carbamamido}phenyl)acetate
Compound characteristics
| Compound ID: | F524-0030 |
| Compound Name: | ethyl (4-{[(5-oxo-2-phenyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]carbamamido}phenyl)acetate |
| Molecular Weight: | 463.51 |
| Molecular Formula: | C23 H21 N5 O4 S |
| Smiles: | CCOC(Cc1ccc(cc1)NC(NCC1=CC(N2C(=N1)SC(c1ccccc1)=N2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9514 |
| logD: | 2.9505 |
| logSw: | -3.5298 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.055 |
| InChI Key: | NFIRQJRHSFKIRW-UHFFFAOYSA-N |