N-(3-benzoyl-1,1-dioxo-2-pentyl-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl)-2-bromobenzamide
Chemical Structure Depiction of
N-(3-benzoyl-1,1-dioxo-2-pentyl-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl)-2-bromobenzamide
N-(3-benzoyl-1,1-dioxo-2-pentyl-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl)-2-bromobenzamide
Compound characteristics
| Compound ID: | 6405-0122 |
| Compound Name: | N-(3-benzoyl-1,1-dioxo-2-pentyl-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl)-2-bromobenzamide |
| Molecular Weight: | 553.47 |
| Molecular Formula: | C27 H25 Br N2 O4 S |
| Smiles: | CCCCCN1C(=C(c2ccccc2S1(=O)=O)NC(c1ccccc1[Br])=O)C(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8179 |
| logD: | 0.2039 |
| logSw: | -5.4795 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.679 |
| InChI Key: | DWCFKXGRPZVUST-UHFFFAOYSA-N |