3-(4-bromophenyl)-8-(2,4-dimethoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Chemical Structure Depiction of
3-(4-bromophenyl)-8-(2,4-dimethoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
3-(4-bromophenyl)-8-(2,4-dimethoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Compound characteristics
| Compound ID: | C499-0723 |
| Compound Name: | 3-(4-bromophenyl)-8-(2,4-dimethoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile |
| Molecular Weight: | 486.39 |
| Molecular Formula: | C22 H20 Br N3 O3 S |
| Smiles: | COc1ccc(C2CC(N3CN(CSC3=C2C#N)c2ccc(cc2)[Br])=O)c(c1)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0958 |
| logD: | 5.0958 |
| logSw: | -4.9307 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.949 |
| InChI Key: | RVHRCYLXVXEIEJ-GOSISDBHSA-N |