8-(2-chlorophenyl)-6-oxo-3-(2,4,6-trimethylphenyl)-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Chemical Structure Depiction of
8-(2-chlorophenyl)-6-oxo-3-(2,4,6-trimethylphenyl)-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
8-(2-chlorophenyl)-6-oxo-3-(2,4,6-trimethylphenyl)-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Compound characteristics
| Compound ID: | C499-1009 |
| Compound Name: | 8-(2-chlorophenyl)-6-oxo-3-(2,4,6-trimethylphenyl)-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile |
| Molecular Weight: | 423.96 |
| Molecular Formula: | C23 H22 Cl N3 O S |
| Smiles: | Cc1cc(C)c(c(C)c1)N1CN2C(=C(C#N)C(CC2=O)c2ccccc2[Cl])SC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.4042 |
| logD: | 6.4042 |
| logSw: | -6.0933 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 37.173 |
| InChI Key: | IXAKCYZEQNIIQJ-SFHVURJKSA-N |