methyl 2-(3-methoxyphenyl)-8-methyl-9-oxo-3H,9H-thieno[2',3':4,5]pyrimido[2,1-b][1,3,4]thiadiazine-7-carboxylate
Chemical Structure Depiction of
methyl 2-(3-methoxyphenyl)-8-methyl-9-oxo-3H,9H-thieno[2',3':4,5]pyrimido[2,1-b][1,3,4]thiadiazine-7-carboxylate
methyl 2-(3-methoxyphenyl)-8-methyl-9-oxo-3H,9H-thieno[2',3':4,5]pyrimido[2,1-b][1,3,4]thiadiazine-7-carboxylate
Compound characteristics
| Compound ID: | K310-0021 |
| Compound Name: | methyl 2-(3-methoxyphenyl)-8-methyl-9-oxo-3H,9H-thieno[2',3':4,5]pyrimido[2,1-b][1,3,4]thiadiazine-7-carboxylate |
| Molecular Weight: | 401.46 |
| Molecular Formula: | C18 H15 N3 O4 S2 |
| Smiles: | Cc1c2C(N3C(=Nc2sc1C(=O)OC)SCC(c1cccc(c1)OC)=N3)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3171 |
| logD: | 3.2761 |
| logSw: | -3.6398 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.183 |
| InChI Key: | RDLHVWJXYXVTQJ-UHFFFAOYSA-N |