N-(2,5-dimethylphenyl)-4-[(4-fluorophenyl)methyl]-1,3-dioxo-1,2,3,4-tetrahydro-1lambda~4~,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
N-(2,5-dimethylphenyl)-4-[(4-fluorophenyl)methyl]-1,3-dioxo-1,2,3,4-tetrahydro-1lambda~4~,4-benzothiazine-6-carboxamide
N-(2,5-dimethylphenyl)-4-[(4-fluorophenyl)methyl]-1,3-dioxo-1,2,3,4-tetrahydro-1lambda~4~,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | C531-0067 |
| Compound Name: | N-(2,5-dimethylphenyl)-4-[(4-fluorophenyl)methyl]-1,3-dioxo-1,2,3,4-tetrahydro-1lambda~4~,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 436.5 |
| Molecular Formula: | C24 H21 F N2 O3 S |
| Smiles: | Cc1ccc(C)c(c1)NC(c1ccc2c(c1)N(Cc1ccc(cc1)F)C(CS2=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.526 |
| logD: | 3.526 |
| logSw: | -3.8808 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.169 |
| InChI Key: | HNBJAFAZLILRSD-UHFFFAOYSA-N |