8-{4-[(4-chlorophenyl)methoxy]phenyl}-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-{4-[(4-chlorophenyl)methoxy]phenyl}-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-{4-[(4-chlorophenyl)methoxy]phenyl}-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: | C499-1116 |
| Compound Name: | 8-{4-[(4-chlorophenyl)methoxy]phenyl}-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: | 492 |
| Molecular Formula: | C26 H22 Cl N3 O3 S |
| Smiles: | C1C(C(C#N)=C2N(CN(Cc3ccco3)CS2)C1=O)c1ccc(cc1)OCc1ccc(cc1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1224 |
| logD: | 5.1224 |
| logSw: | -5.8019 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.031 |
| InChI Key: | KRJXSYNJRYTHML-QHCPKHFHSA-N |