8-(2,6-dichlorophenyl)-3-(3-methylphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Chemical Structure Depiction of
8-(2,6-dichlorophenyl)-3-(3-methylphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
8-(2,6-dichlorophenyl)-3-(3-methylphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Compound characteristics
| Compound ID: | C499-1044 |
| Compound Name: | 8-(2,6-dichlorophenyl)-3-(3-methylphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile |
| Molecular Weight: | 430.35 |
| Molecular Formula: | C21 H17 Cl2 N3 O S |
| Smiles: | Cc1cccc(c1)N1CN2C(=C(C#N)C(CC2=O)c2c(cccc2[Cl])[Cl])SC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0051 |
| logD: | 5.0051 |
| logSw: | -5.0883 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 37.775 |
| InChI Key: | PPTRFGPATXDJIO-OAHLLOKOSA-N |