N-(4-bromo-3-methylphenyl)-2-[3-oxo-2-(pyrrolidine-1-carbonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide
Chemical Structure Depiction of
N-(4-bromo-3-methylphenyl)-2-[3-oxo-2-(pyrrolidine-1-carbonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide
N-(4-bromo-3-methylphenyl)-2-[3-oxo-2-(pyrrolidine-1-carbonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide
Compound characteristics
| Compound ID: | L592-0525 |
| Compound Name: | N-(4-bromo-3-methylphenyl)-2-[3-oxo-2-(pyrrolidine-1-carbonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide |
| Molecular Weight: | 488.4 |
| Molecular Formula: | C22 H22 Br N3 O3 S |
| Smiles: | Cc1cc(ccc1[Br])NC(CN1C(C(C(N2CCCC2)=O)Sc2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1077 |
| logD: | 4.1076 |
| logSw: | -4.1731 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.505 |
| InChI Key: | RVRITVINIHDMJA-HXUWFJFHSA-N |