8-(2-methylphenyl)-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-methylphenyl)-3-(3-methylphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
8-(2-methylphenyl)-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: | C499-0098 |
Compound Name: | 8-(2-methylphenyl)-3-(3-methylphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile |
Molecular Weight: | 375.49 |
Molecular Formula: | C22 H21 N3 O S |
Smiles: | Cc1cccc(c1)N1CN2C(=C(C#N)C(CC2=O)c2ccccc2C)SC1 |
Stereo: | RACEMIC MIXTURE |
logP: | 4.9278 |
logD: | 4.9278 |
logSw: | -4.6811 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 37.775 |
InChI Key: | AUGJGCLZUWFEJD-LJQANCHMSA-N |