N-{[2-(3-methylphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-{[2-(3-methylphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}thiophene-2-carboxamide
N-{[2-(3-methylphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | F527-0176 |
| Compound Name: | N-{[2-(3-methylphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}thiophene-2-carboxamide |
| Molecular Weight: | 382.46 |
| Molecular Formula: | C18 H14 N4 O2 S2 |
| Smiles: | Cc1cccc(c1)C1=NN2C(=NC(CNC(c3cccs3)=O)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 2.9802 |
| logD: | 2.9791 |
| logSw: | -3.3342 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.702 |
| InChI Key: | KDDCLEBISSYHRV-UHFFFAOYSA-N |