N-(1,3-benzothiazol-2-yl)-2-[3-oxo-6-(pyrrolidine-1-carbonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide
Chemical Structure Depiction of
N-(1,3-benzothiazol-2-yl)-2-[3-oxo-6-(pyrrolidine-1-carbonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide
N-(1,3-benzothiazol-2-yl)-2-[3-oxo-6-(pyrrolidine-1-carbonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide
Compound characteristics
| Compound ID: | F510-0066 |
| Compound Name: | N-(1,3-benzothiazol-2-yl)-2-[3-oxo-6-(pyrrolidine-1-carbonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide |
| Molecular Weight: | 452.55 |
| Molecular Formula: | C22 H20 N4 O3 S2 |
| Smiles: | C1CCN(C1)C(c1ccc2c(c1)N(CC(Nc1nc3ccccc3s1)=O)C(CS2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1889 |
| logD: | 3.1889 |
| logSw: | -3.5008 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.544 |
| InChI Key: | JSYBIZIZBVVCRT-UHFFFAOYSA-N |