8-methyl-N-(3-methylphenyl)-9-oxo-2-phenyl-3H,9H-thieno[2',3':4,5]pyrimido[2,1-b][1,3,4]thiadiazine-7-carboxamide
Chemical Structure Depiction of
8-methyl-N-(3-methylphenyl)-9-oxo-2-phenyl-3H,9H-thieno[2',3':4,5]pyrimido[2,1-b][1,3,4]thiadiazine-7-carboxamide
8-methyl-N-(3-methylphenyl)-9-oxo-2-phenyl-3H,9H-thieno[2',3':4,5]pyrimido[2,1-b][1,3,4]thiadiazine-7-carboxamide
Compound characteristics
| Compound ID: | E149-0057 |
| Compound Name: | 8-methyl-N-(3-methylphenyl)-9-oxo-2-phenyl-3H,9H-thieno[2',3':4,5]pyrimido[2,1-b][1,3,4]thiadiazine-7-carboxamide |
| Molecular Weight: | 446.55 |
| Molecular Formula: | C23 H18 N4 O2 S2 |
| Smiles: | Cc1cccc(c1)NC(c1c(C)c2C(N3C(=Nc2s1)SCC(c1ccccc1)=N3)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5974 |
| logD: | 4.5868 |
| logSw: | -4.471 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.557 |
| InChI Key: | PYIGFFLCGBCPHQ-UHFFFAOYSA-N |