N-[(3-bromophenyl)methyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-2-carbonyl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-[(3-bromophenyl)methyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-2-carbonyl)piperidine-3-carboxamide
N-[(3-bromophenyl)methyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-2-carbonyl)piperidine-3-carboxamide
Compound characteristics
Compound ID: | L795-0342 |
Compound Name: | N-[(3-bromophenyl)methyl]-1-(3-oxo-3,4-dihydro-2H-1,4-benzothiazine-2-carbonyl)piperidine-3-carboxamide |
Molecular Weight: | 488.4 |
Molecular Formula: | C22 H22 Br N3 O3 S |
Smiles: | C1CC(CN(C1)C(C1C(Nc2ccccc2S1)=O)=O)C(NCc1cccc(c1)[Br])=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 2.6686 |
logD: | 2.6686 |
logSw: | -3.0963 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 66.111 |
InChI Key: | KEEGERGZHWKFCR-UHFFFAOYSA-N |