ethyl 4-(9-cyano-6-oxo-8-phenyl-7,8-dihydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazin-3(4H)-yl)benzoate
Chemical Structure Depiction of
ethyl 4-(9-cyano-6-oxo-8-phenyl-7,8-dihydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazin-3(4H)-yl)benzoate
ethyl 4-(9-cyano-6-oxo-8-phenyl-7,8-dihydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazin-3(4H)-yl)benzoate
Compound characteristics
| Compound ID: | C499-0432 |
| Compound Name: | ethyl 4-(9-cyano-6-oxo-8-phenyl-7,8-dihydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazin-3(4H)-yl)benzoate |
| Molecular Weight: | 419.5 |
| Molecular Formula: | C23 H21 N3 O3 S |
| Smiles: | CCOC(c1ccc(cc1)N1CN2C(=C(C#N)C(CC2=O)c2ccccc2)SC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7092 |
| logD: | 4.7092 |
| logSw: | -4.3249 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.528 |
| InChI Key: | UPQLMILMUFCROP-LJQANCHMSA-N |