8-(3-methoxyphenyl)-3-(4-methoxyphenyl)-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)-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)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Compound characteristics
| Compound ID: | C499-0670 |
| Compound Name: | 8-(3-methoxyphenyl)-3-(4-methoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile |
| Molecular Weight: | 407.49 |
| Molecular Formula: | C22 H21 N3 O3 S |
| Smiles: | COc1ccc(cc1)N1CN2C(=C(C#N)C(CC2=O)c2cccc(c2)OC)SC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1428 |
| logD: | 4.1428 |
| logSw: | -4.3509 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.862 |
| InChI Key: | LJEYUIFLRFMRKF-LJQANCHMSA-N |