N-{3-[(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-{3-[(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}thiophene-2-carboxamide
N-{3-[(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | C679-4000 |
| Compound Name: | N-{3-[(2-methyl-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}thiophene-2-carboxamide |
| Molecular Weight: | 398.46 |
| Molecular Formula: | C18 H14 N4 O3 S2 |
| Smiles: | CC1=NN2C(=NC(COc3cccc(c3)NC(c3cccs3)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.0969 |
| logD: | 3.0918 |
| logSw: | -3.4072 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.053 |
| InChI Key: | ZKQIHRVYKDPQRT-UHFFFAOYSA-N |