tert-butyl 1-(4-chlorophenyl)-4,4-dioxo-1,4-dihydro-4lambda~6~-pyrido[2,3-e][1,3,4]thiadiazine-3-carboxylate
Chemical Structure Depiction of
tert-butyl 1-(4-chlorophenyl)-4,4-dioxo-1,4-dihydro-4lambda~6~-pyrido[2,3-e][1,3,4]thiadiazine-3-carboxylate
tert-butyl 1-(4-chlorophenyl)-4,4-dioxo-1,4-dihydro-4lambda~6~-pyrido[2,3-e][1,3,4]thiadiazine-3-carboxylate
Compound characteristics
| Compound ID: | M831-0318 |
| Compound Name: | tert-butyl 1-(4-chlorophenyl)-4,4-dioxo-1,4-dihydro-4lambda~6~-pyrido[2,3-e][1,3,4]thiadiazine-3-carboxylate |
| Molecular Weight: | 393.85 |
| Molecular Formula: | C17 H16 Cl N3 O4 S |
| Smiles: | CC(C)(C)OC(C1=NN(c2ccc(cc2)[Cl])c2c(cccn2)S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4144 |
| logD: | 3.4144 |
| logSw: | -3.9034 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.464 |
| InChI Key: | MEBZGLSYGRXCPP-UHFFFAOYSA-N |