N-(3,5-dimethylphenyl)-8-methyl-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
N-(3,5-dimethylphenyl)-8-methyl-9-oxo-2-phenyl-3H,9H-thieno[2',3':4,5]pyrimido[2,1-b][1,3,4]thiadiazine-7-carboxamide
N-(3,5-dimethylphenyl)-8-methyl-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: | K310-0052 |
| Compound Name: | N-(3,5-dimethylphenyl)-8-methyl-9-oxo-2-phenyl-3H,9H-thieno[2',3':4,5]pyrimido[2,1-b][1,3,4]thiadiazine-7-carboxamide |
| Molecular Weight: | 460.58 |
| Molecular Formula: | C24 H20 N4 O2 S2 |
| Smiles: | Cc1cc(C)cc(c1)NC(c1c(C)c2C(N3C(=Nc2s1)SCC(c1ccccc1)=N3)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9304 |
| logD: | 4.92 |
| logSw: | -4.6749 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.557 |
| InChI Key: | AXIAKNLNKJUQSM-UHFFFAOYSA-N |