8-(2,4-dimethoxyphenyl)-3-[(furan-2-yl)methyl]-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Chemical Structure Depiction of
8-(2,4-dimethoxyphenyl)-3-[(furan-2-yl)methyl]-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
8-(2,4-dimethoxyphenyl)-3-[(furan-2-yl)methyl]-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Compound characteristics
| Compound ID: | C499-0709 |
| Compound Name: | 8-(2,4-dimethoxyphenyl)-3-[(furan-2-yl)methyl]-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile |
| Molecular Weight: | 411.48 |
| Molecular Formula: | C21 H21 N3 O4 S |
| Smiles: | COc1ccc(C2CC(N3CN(Cc4ccco4)CSC3=C2C#N)=O)c(c1)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2718 |
| logD: | 3.2718 |
| logSw: | -3.3679 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.978 |
| InChI Key: | PPHNCDVCMDWNMF-QGZVFWFLSA-N |