N-(4-chlorophenyl)-2-[3-oxo-6-(pyrrolidine-1-carbonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-2-[3-oxo-6-(pyrrolidine-1-carbonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide
N-(4-chlorophenyl)-2-[3-oxo-6-(pyrrolidine-1-carbonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide
Compound characteristics
Compound ID: | F510-0023 |
Compound Name: | N-(4-chlorophenyl)-2-[3-oxo-6-(pyrrolidine-1-carbonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide |
Molecular Weight: | 429.92 |
Molecular Formula: | C21 H20 Cl N3 O3 S |
Smiles: | C1CCN(C1)C(c1ccc2c(c1)N(CC(Nc1ccc(cc1)[Cl])=O)C(CS2)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.014 |
logD: | 3.0138 |
logSw: | -3.6932 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.783 |
InChI Key: | JKHCSMHPSBMKNJ-UHFFFAOYSA-N |