3-(3-chlorophenyl)-8-(2,6-dichlorophenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Chemical Structure Depiction of
3-(3-chlorophenyl)-8-(2,6-dichlorophenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
3-(3-chlorophenyl)-8-(2,6-dichlorophenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Compound characteristics
| Compound ID: | C499-1042 |
| Compound Name: | 3-(3-chlorophenyl)-8-(2,6-dichlorophenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile |
| Molecular Weight: | 450.77 |
| Molecular Formula: | C20 H14 Cl3 N3 O S |
| Smiles: | C1C(C(C#N)=C2N(CN(CS2)c2cccc(c2)[Cl])C1=O)c1c(cccc1[Cl])[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1462 |
| logD: | 5.1462 |
| logSw: | -5.6342 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 37.775 |
| InChI Key: | AWIWZHFNNYMQBQ-CQSZACIVSA-N |