8-(4-ethoxyphenyl)-6-oxo-3-[(pyridin-3-yl)methyl]-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Chemical Structure Depiction of
8-(4-ethoxyphenyl)-6-oxo-3-[(pyridin-3-yl)methyl]-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
8-(4-ethoxyphenyl)-6-oxo-3-[(pyridin-3-yl)methyl]-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Compound characteristics
| Compound ID: | D006-0274 |
| Compound Name: | 8-(4-ethoxyphenyl)-6-oxo-3-[(pyridin-3-yl)methyl]-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile |
| Molecular Weight: | 406.51 |
| Molecular Formula: | C22 H22 N4 O2 S |
| Smiles: | CCOc1ccc(cc1)C1CC(N2CN(Cc3cccnc3)CSC2=C1C#N)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7617 |
| logD: | 2.7613 |
| logSw: | -2.5703 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.696 |
| InChI Key: | YDKWVXIRCPNXFW-LJQANCHMSA-N |