8-(3-methoxyphenyl)-3-[(4-methoxyphenyl)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-(3-methoxyphenyl)-3-[(4-methoxyphenyl)methyl]-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
8-(3-methoxyphenyl)-3-[(4-methoxyphenyl)methyl]-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Compound characteristics
| Compound ID: | D006-0099 |
| Compound Name: | 8-(3-methoxyphenyl)-3-[(4-methoxyphenyl)methyl]-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile |
| Molecular Weight: | 421.52 |
| Molecular Formula: | C23 H23 N3 O3 S |
| Smiles: | COc1ccc(CN2CN3C(=C(C#N)C(CC3=O)c3cccc(c3)OC)SC2)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7452 |
| logD: | 3.7452 |
| logSw: | -4.0457 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.142 |
| InChI Key: | NZXDQQQNAXMUCT-HXUWFJFHSA-N |