2-benzyl-4-[4-(methylsulfanyl)phenyl]-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazine-1,1,3(2H,4H)-trione
Chemical Structure Depiction of
2-benzyl-4-[4-(methylsulfanyl)phenyl]-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazine-1,1,3(2H,4H)-trione
2-benzyl-4-[4-(methylsulfanyl)phenyl]-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazine-1,1,3(2H,4H)-trione
Compound characteristics
| Compound ID: | P799-0390 |
| Compound Name: | 2-benzyl-4-[4-(methylsulfanyl)phenyl]-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazine-1,1,3(2H,4H)-trione |
| Molecular Weight: | 411.5 |
| Molecular Formula: | C20 H17 N3 O3 S2 |
| Smiles: | CSc1ccc(cc1)N1C(N(Cc2ccccc2)S(c2cccnc12)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.627 |
| logD: | 3.627 |
| logSw: | -3.7784 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.679 |
| InChI Key: | DTXNKTOCZBLGGG-UHFFFAOYSA-N |