6-oxo-3,8-diphenyl-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Chemical Structure Depiction of
6-oxo-3,8-diphenyl-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
6-oxo-3,8-diphenyl-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Compound characteristics
| Compound ID: | C499-0428 |
| Compound Name: | 6-oxo-3,8-diphenyl-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile |
| Molecular Weight: | 347.44 |
| Molecular Formula: | C20 H17 N3 O S |
| Smiles: | C1C(C(C#N)=C2N(CN(CS2)c2ccccc2)C1=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9862 |
| logD: | 3.9862 |
| logSw: | -4.1754 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 37.775 |
| InChI Key: | SAQIKFAPKCJYLV-QGZVFWFLSA-N |