3-(2-ethylphenyl)-8-(2-methoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Chemical Structure Depiction of
3-(2-ethylphenyl)-8-(2-methoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
3-(2-ethylphenyl)-8-(2-methoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Compound characteristics
| Compound ID: | C499-0468 |
| Compound Name: | 3-(2-ethylphenyl)-8-(2-methoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile |
| Molecular Weight: | 405.52 |
| Molecular Formula: | C23 H23 N3 O2 S |
| Smiles: | CCc1ccccc1N1CN2C(=C(C#N)C(CC2=O)c2ccccc2OC)SC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9054 |
| logD: | 4.9054 |
| logSw: | -4.5653 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.104 |
| InChI Key: | KIVKBGGSVCOTGL-GOSISDBHSA-N |