2-oxo-2-[(4-oxo-3,4-dihydro-2H-1,3-benzothiazin-2-ylidene)amino]ethyl piperidine-1-carbodithioate
Chemical Structure Depiction of
2-oxo-2-[(4-oxo-3,4-dihydro-2H-1,3-benzothiazin-2-ylidene)amino]ethyl piperidine-1-carbodithioate
2-oxo-2-[(4-oxo-3,4-dihydro-2H-1,3-benzothiazin-2-ylidene)amino]ethyl piperidine-1-carbodithioate
Compound characteristics
| Compound ID: | Y020-5623 |
| Compound Name: | 2-oxo-2-[(4-oxo-3,4-dihydro-2H-1,3-benzothiazin-2-ylidene)amino]ethyl piperidine-1-carbodithioate |
| Molecular Weight: | 379.52 |
| Molecular Formula: | C16 H17 N3 O2 S3 |
| Smiles: | C1CCN(CC1)C(=S)SCC(/N=C1/NC(c2ccccc2S1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6789 |
| logD: | 0.4915 |
| logSw: | -3.4755 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.844 |
| InChI Key: | BPWJBJYSAFWLOX-UHFFFAOYSA-N |