N,N-diethyl-4-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
N,N-diethyl-4-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
N,N-diethyl-4-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | F510-0520 |
| Compound Name: | N,N-diethyl-4-{2-[3-(methylsulfanyl)anilino]-2-oxoethyl}-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 443.59 |
| Molecular Formula: | C22 H25 N3 O3 S2 |
| Smiles: | CCN(CC)C(c1ccc2c(c1)N(CC(Nc1cccc(c1)SC)=O)C(CS2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8181 |
| logD: | 2.8181 |
| logSw: | -3.3493 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.7 |
| InChI Key: | YEVSIGMQVAJKSL-UHFFFAOYSA-N |