3-cyclopentyl-8-(4-ethoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Chemical Structure Depiction of
3-cyclopentyl-8-(4-ethoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
3-cyclopentyl-8-(4-ethoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Compound characteristics
| Compound ID: | D006-0277 |
| Compound Name: | 3-cyclopentyl-8-(4-ethoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile |
| Molecular Weight: | 383.51 |
| Molecular Formula: | C21 H25 N3 O2 S |
| Smiles: | CCOc1ccc(cc1)C1CC(N2CN(CSC2=C1C#N)C1CCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7849 |
| logD: | 3.7842 |
| logSw: | -3.7901 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.097 |
| InChI Key: | LSZHKNGJJBSCEW-GOSISDBHSA-N |