4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[(oxolan-2-yl)methyl]benzamide
Chemical Structure Depiction of
4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[(oxolan-2-yl)methyl]benzamide
4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[(oxolan-2-yl)methyl]benzamide
Compound characteristics
| Compound ID: | K788-8899 |
| Compound Name: | 4-({4-[(3-chlorophenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-2-ylidene}methyl)-N-[(oxolan-2-yl)methyl]benzamide |
| Molecular Weight: | 505.04 |
| Molecular Formula: | C28 H25 Cl N2 O3 S |
| Smiles: | C1CC(CNC(c2ccc(/C=C3/C(N(Cc4cccc(c4)[Cl])c4ccccc4S3)=O)cc2)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3478 |
| logD: | 5.3478 |
| logSw: | -5.9447 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.137 |
| InChI Key: | RFLNRCQBYPPEDV-HSZRJFAPSA-N |