3-[(4-methoxyphenyl)methyl]-8-(4-methylphenyl)-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-methoxyphenyl)methyl]-8-(4-methylphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
3-[(4-methoxyphenyl)methyl]-8-(4-methylphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Compound characteristics
| Compound ID: | D006-0145 |
| Compound Name: | 3-[(4-methoxyphenyl)methyl]-8-(4-methylphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile |
| Molecular Weight: | 405.52 |
| Molecular Formula: | C23 H23 N3 O2 S |
| Smiles: | Cc1ccc(cc1)C1CC(N2CN(Cc3ccc(cc3)OC)CSC2=C1C#N)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1117 |
| logD: | 4.1117 |
| logSw: | -4.087 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.598 |
| InChI Key: | KCQWAJYSKRAKMG-HXUWFJFHSA-N |