N-(3-benzoyl-1,1-dioxo-2-pentyl-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl)-2-(4-methylphenoxy)acetamide
Chemical Structure Depiction of
N-(3-benzoyl-1,1-dioxo-2-pentyl-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl)-2-(4-methylphenoxy)acetamide
N-(3-benzoyl-1,1-dioxo-2-pentyl-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl)-2-(4-methylphenoxy)acetamide
Compound characteristics
| Compound ID: | 6405-0111 |
| Compound Name: | N-(3-benzoyl-1,1-dioxo-2-pentyl-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl)-2-(4-methylphenoxy)acetamide |
| Molecular Weight: | 518.63 |
| Molecular Formula: | C29 H30 N2 O5 S |
| Smiles: | CCCCCN1C(=C(c2ccccc2S1(=O)=O)NC(COc1ccc(C)cc1)=O)C(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9394 |
| logD: | 2.7204 |
| logSw: | -5.4078 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.965 |
| InChI Key: | MRVYNFQWDVCZTL-UHFFFAOYSA-N |