3-(3-chloro-4-methylphenyl)-8-(2-chlorophenyl)-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-chloro-4-methylphenyl)-8-(2-chlorophenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
3-(3-chloro-4-methylphenyl)-8-(2-chlorophenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Compound characteristics
Compound ID: | C499-0230 |
Compound Name: | 3-(3-chloro-4-methylphenyl)-8-(2-chlorophenyl)-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: | Cc1ccc(cc1[Cl])N1CN2C(=C(C#N)C(CC2=O)c2ccccc2[Cl])SC1 |
Stereo: | RACEMIC MIXTURE |
logP: | 5.8306 |
logD: | 5.8306 |
logSw: | -5.9282 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 37.775 |
InChI Key: | SFMPKSDVEZXKJS-MRXNPFEDSA-N |