N-[(3,5-difluorophenyl)methyl]-1-(4-methylphenyl)-4,4-dioxo-1,4-dihydro-4lambda~6~-pyrido[2,3-e][1,3,4]thiadiazine-3-carboxamide
Chemical Structure Depiction of
N-[(3,5-difluorophenyl)methyl]-1-(4-methylphenyl)-4,4-dioxo-1,4-dihydro-4lambda~6~-pyrido[2,3-e][1,3,4]thiadiazine-3-carboxamide
N-[(3,5-difluorophenyl)methyl]-1-(4-methylphenyl)-4,4-dioxo-1,4-dihydro-4lambda~6~-pyrido[2,3-e][1,3,4]thiadiazine-3-carboxamide
Compound characteristics
| Compound ID: | M789-1063 |
| Compound Name: | N-[(3,5-difluorophenyl)methyl]-1-(4-methylphenyl)-4,4-dioxo-1,4-dihydro-4lambda~6~-pyrido[2,3-e][1,3,4]thiadiazine-3-carboxamide |
| Molecular Weight: | 442.44 |
| Molecular Formula: | C21 H16 F2 N4 O3 S |
| Smiles: | Cc1ccc(cc1)N1c2c(cccn2)S(C(C(NCc2cc(cc(c2)F)F)=O)=N1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.361 |
| logD: | 3.361 |
| logSw: | -3.6666 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.014 |
| InChI Key: | XASNCXCHAUKWLW-UHFFFAOYSA-N |