N-{3-[(5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-{3-[(5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}thiophene-2-carboxamide
N-{3-[(5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | C679-6503 |
| Compound Name: | N-{3-[(5-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methoxy]phenyl}thiophene-2-carboxamide |
| Molecular Weight: | 426.51 |
| Molecular Formula: | C20 H18 N4 O3 S2 |
| Smiles: | CCCC1=NN2C(=NC(COc3cccc(c3)NC(c3cccs3)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 4.0051 |
| logD: | 4.001 |
| logSw: | -4.116 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.783 |
| InChI Key: | UQNHKBVHMFQICC-UHFFFAOYSA-N |