2-[(3-methoxyphenyl)methyl]-4-[3-(methylsulfanyl)phenyl]-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazine-1,1,3(2H,4H)-trione
Chemical Structure Depiction of
2-[(3-methoxyphenyl)methyl]-4-[3-(methylsulfanyl)phenyl]-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazine-1,1,3(2H,4H)-trione
2-[(3-methoxyphenyl)methyl]-4-[3-(methylsulfanyl)phenyl]-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazine-1,1,3(2H,4H)-trione
Compound characteristics
| Compound ID: | P799-0358 |
| Compound Name: | 2-[(3-methoxyphenyl)methyl]-4-[3-(methylsulfanyl)phenyl]-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazine-1,1,3(2H,4H)-trione |
| Molecular Weight: | 441.53 |
| Molecular Formula: | C21 H19 N3 O4 S2 |
| Smiles: | COc1cccc(CN2C(N(c3cccc(c3)SC)c3c(cccn3)S2(=O)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.3913 |
| logD: | 3.3913 |
| logSw: | -3.8169 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.222 |
| InChI Key: | VQJIERVKXKVMHE-UHFFFAOYSA-N |