6-oxo-3-(1-phenylethyl)-8-(thiophen-2-yl)-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Chemical Structure Depiction of
6-oxo-3-(1-phenylethyl)-8-(thiophen-2-yl)-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
6-oxo-3-(1-phenylethyl)-8-(thiophen-2-yl)-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Compound characteristics
| Compound ID: | D006-0378 |
| Compound Name: | 6-oxo-3-(1-phenylethyl)-8-(thiophen-2-yl)-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile |
| Molecular Weight: | 381.52 |
| Molecular Formula: | C20 H19 N3 O S2 |
| Smiles: | CC(c1ccccc1)N1CN2C(=C(C#N)C(CC2=O)c2cccs2)SC1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8653 |
| logD: | 3.8653 |
| logSw: | -3.9504 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.745 |
| InChI Key: | ZFYSAVGGCFAPFH-UHFFFAOYSA-N |