3-(3-ethyl-1,1-dioxo-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazin-4(1H)-yl)benzonitrile
Chemical Structure Depiction of
3-(3-ethyl-1,1-dioxo-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazin-4(1H)-yl)benzonitrile
3-(3-ethyl-1,1-dioxo-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazin-4(1H)-yl)benzonitrile
Compound characteristics
| Compound ID: | P798-0068 |
| Compound Name: | 3-(3-ethyl-1,1-dioxo-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazin-4(1H)-yl)benzonitrile |
| Molecular Weight: | 312.35 |
| Molecular Formula: | C15 H12 N4 O2 S |
| Smiles: | CCC1=NS(c2cccnc2N1c1cccc(C#N)c1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5451 |
| logD: | 1.5387 |
| logSw: | -2.0337 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 70.195 |
| InChI Key: | VFOZPUYPXWILMB-UHFFFAOYSA-N |