2-benzylidene-N-[3-(butylsulfanyl)propyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
2-benzylidene-N-[3-(butylsulfanyl)propyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
2-benzylidene-N-[3-(butylsulfanyl)propyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | K788-9494 |
| Compound Name: | 2-benzylidene-N-[3-(butylsulfanyl)propyl]-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 426.6 |
| Molecular Formula: | C23 H26 N2 O2 S2 |
| Smiles: | CCCCSCCCNC(c1ccc2c(c1)NC(/C(=C/c1ccccc1)S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0468 |
| logD: | 5.0468 |
| logSw: | -4.6638 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.371 |
| InChI Key: | HWIUCPZCYQATMQ-UHFFFAOYSA-N |