N-butyl-2-{4-[(4-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}acetamide
Chemical Structure Depiction of
N-butyl-2-{4-[(4-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}acetamide
N-butyl-2-{4-[(4-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}acetamide
Compound characteristics
| Compound ID: | K788-0503 |
| Compound Name: | N-butyl-2-{4-[(4-fluorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}acetamide |
| Molecular Weight: | 384.47 |
| Molecular Formula: | C21 H21 F N2 O2 S |
| Smiles: | CCCCNC(/C=C1/C(N(Cc2ccc(cc2)F)c2ccccc2S1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5404 |
| logD: | 4.5404 |
| logSw: | -4.1985 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.654 |
| InChI Key: | OOMCVFDQPWUDTF-UYRXBGFRSA-N |