3-(4-ethoxyphenyl)-8-[4-(methylsulfanyl)phenyl]-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Chemical Structure Depiction of
3-(4-ethoxyphenyl)-8-[4-(methylsulfanyl)phenyl]-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
3-(4-ethoxyphenyl)-8-[4-(methylsulfanyl)phenyl]-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Compound characteristics
| Compound ID: | C499-0999 |
| Compound Name: | 3-(4-ethoxyphenyl)-8-[4-(methylsulfanyl)phenyl]-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile |
| Molecular Weight: | 437.58 |
| Molecular Formula: | C23 H23 N3 O2 S2 |
| Smiles: | CCOc1ccc(cc1)N1CN2C(=C(C#N)C(CC2=O)c2ccc(cc2)SC)SC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1918 |
| logD: | 5.1918 |
| logSw: | -4.9652 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.898 |
| InChI Key: | SYBCHRJYVHXVMW-HXUWFJFHSA-N |