[4-(4-methylphenyl)-1,1-dioxo-3,4-dihydro-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazin-2(1H)-yl]acetonitrile
Chemical Structure Depiction of
[4-(4-methylphenyl)-1,1-dioxo-3,4-dihydro-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazin-2(1H)-yl]acetonitrile
[4-(4-methylphenyl)-1,1-dioxo-3,4-dihydro-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazin-2(1H)-yl]acetonitrile
Compound characteristics
| Compound ID: | P585-2047 |
| Compound Name: | [4-(4-methylphenyl)-1,1-dioxo-3,4-dihydro-1lambda~6~-pyrido[2,3-e][1,2,4]thiadiazin-2(1H)-yl]acetonitrile |
| Molecular Weight: | 314.36 |
| Molecular Formula: | C15 H14 N4 O2 S |
| Smiles: | Cc1ccc(cc1)N1CN(CC#N)S(c2cccnc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2177 |
| logD: | 2.2177 |
| logSw: | -2.4199 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.557 |
| InChI Key: | DFVJCHKTVUKHKK-UHFFFAOYSA-N |